Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.50 |
| ▸ | TYR | P14679 | 2/20 | 0.46 |
| ▸ | HTT | P42858 | 2/20 | 0.42 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.42 |
| ▸ | IDO1 | P14902 | 2/20 | 0.41 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.40 |
| ▸ | MGLL | Q99685 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.38 |
| ▸ | HIF1A | Q16665 | 3/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.37 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.37 |
| ▸ | CACNA1C | Q13936 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL30496691 | 0.97 | TSHR (0.48) | TSHRTYRHTTADRB2IDO1 | |
| SCHEMBL3184041 | 0.97 | TSHR (0.48) | TSHRTYRHTTADRB2IDO1 | |
| SCHEMBL104124 | 0.83 | TYR (0.58) | TYRHTTADRB2IDO1NFKB1 | |
| SCHEMBL5075045 | 0.83 | TSHR (0.67) | TSHRADRB2LMNAHIF1AMAPK1 | |
| SCHEMBL8750387 | 0.81 | TYR (0.46) | TSHRTYRHTTADRB2IDO1 | |
| SCHEMBL30471741 | 0.81 | TYR (0.46) | TSHRTYRHTTADRB2IDO1 | |
| Ammonia Solution, Strong SCHEMBL7550588 | 0.79 | TYR (0.55) | TYRHTTADRB2IDO1NFKB1 | |
| SCHEMBL28912214 | 0.79 | TYR (0.55) | TYRHTTADRB2IDO1NFKB1 | |
| Water SCHEMBL11726962 | 0.79 | TYR (0.55) | TYRHTTADRB2IDO1NFKB1 | |
| Hydrochloric Acid SCHEMBL11505822 | 0.79 | TSHR (0.62) | TSHRADRB2IDO1LMNAHIF1A |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 55 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2018158674-A1 | ASYMMETRIC SYNTHESIS OF (S)-3-(1-(DIMETHYLAMINO) ETHYL) PHENYLETHYL(METHYL)CARBAMATE AND ITS SALTS | TROY LIFE SCIENCES (IN) | 2018-09-07 | — | — | WO | claimed |
| US-8921561-B2 | One-pot preparation of hexahydroisoquinolines from amides | MALLINCKRODT LLC (US) | 2014-12-30 | — | — | US | claimed |
| US-20130137874-A1 | One-Pot Preparation of Hexahydroisoquinolines from Amides | MALLINCKRODT LLC (US) | 2013-05-30 | — | — | US | claimed |
| US-8431705-B2 | One-pot preparation of hexahydroisoquinolines from amides | MALLINCKRODT LLC (US) | 2013-04-30 | — | — | US | claimed |
| WO-2012096824-A1 | PHENYLGLYOXYLIC ACID DERIVATIVES AND THEIR PREPARATION AND USE | TRANSTECH PHARMA, INC. (US) | 2012-07-19 | — | — | WO | claimed |
| WO-2011038172-A1 | ONE-POT PREPARATION OF HEXAHYDROISOQUINOLINES FROM DIHYDROISOQUINOLINES | MALLINCKRODT INC. (US) | 2011-03-31 | — | — | WO | claimed |
| WO-2011038169-A2 | ONE-POT PREPARATION OF HEXAHYDROISOQUINOLINES FROM AMIDES | MALLINCKRODT INC. (US) | 2011-03-31 | — | — | WO | claimed |
| US-20110071300-A1 | One-Pot Preparation of Hexahydroisoquinolines from Dihydroisoquinolines | MALLINCKRODT INC. (US) | 2011-03-24 | — | — | US | claimed |
| US-20110071299-A1 | One-Pot Preparation of Hexahydroisoquinolines from Amides | MALLINCKRODT INC. (US) | 2011-03-24 | — | — | US | claimed |
| US-20240059710-A1 | KRAS G12D Inhibitors | JACOBIO PHARMACEUTICALS CO., LTD. (CN) | 2024-02-22 | — | — | US | disclosed |
| US-20240025918-A1 | KRAS G12D Inhibitors | JACOBIO PHARMACEUTICALS CO., LTD. (CN) | 2024-01-25 | — | — | US | disclosed |
| CN-114029091-B | Dual ligand catalytic system for ethylene selective trimerization, preparation method and application thereof | 浙江智英石化技术有限公司 | 2024-01-16 | — | — | CN | disclosed |
| WO-2023056951-A1 | ARYL-SUBSTITUTED HETEROCYCLIC COMPOUND | 杭州德睿智药科技有限公司 | 2023-04-13 | — | — | WO | disclosed |
| US-20230081426-A1 | COMPOUNDS AND METHODS FOR KRAS MODULATION AND INDICATIONS THEREFOR | PLEXXIKON INC. | 2023-03-16 | — | — | US | disclosed |
| US-20070032664-A1 | Novel process for the synthesis of 5-(4-fluorophenyl)-1-[2-((2R,4R)-4-hydroxy-6-oxo-tetrahydro-pyran-2-yl)-ethyl]-2-isopropyl-4-phenyl-1H-pyrrole-3-carboxylic acid phenylamide | BUTLER DONALD E | 2007-02-08 | — | — | US | disclosed |
| EP-1734034-A2 | Carboxylic acid salts of beta-alanine esters or -amides | Warner-Lambert Company LLC (US) | 2006-12-20 | — | — | EP | disclosed |
| EP-1728785-A1 | 7-[(2-(4-fluorophenyl)-5-isopropyl-3-phenyl-4-phenylcarbamoyl-pyrrol-1-yl]-heptanoic acid ester 3,5-dioxo-acetal | Warner-Lambert Company LLC (US) | 2006-12-06 | — | — | EP | disclosed |
| EP-1724256-A2 | Novel process for the synthesis of 5-(4-fluorphenyl)-1-2(2-((2r,4r)-4-hydroxy-6-oxo-tetrahydro-pyran-2-yl)-ethyl)-2-isopropyl-4-phenyl-1h-pyrrole-3-carboxylic acid phenylamide | Warner-Lambert Company LLC (US) | 2006-11-22 | — | — | EP | disclosed |
| US-20050239869-A1 | Novel process for the synthesis of 5-(4-fluorophenyl)-1-[2-((2R,4R)-4-hydroxy-6-oxo-tetrahydro-pyran-2-yl)-ethyl]-2-isopropyl-4-phenyl-1eta-pyrrole-3-carboxylic acid phenylamide | BUTLER DONALD E | 2005-10-27 | — | — | US | disclosed |
| US-20020133026-A1 | NOVEL PROCESS FOR THE SYNTHESIS OF 5-(4-FLUOROPHENYL)-1-[2-((2R,4R)-4-HYDROXY-6-OXO-TETRAHYDRO-PYRAN-2-YL)-ETHYL]-2-ISOPROPYL-4-PHENYL-1H-PYRROLE-3-CARBOXYLIC ACID PHENYLAMIDE | BUTLER DONALD EUGENE (US) | 2002-09-19 | — | — | US | disclosed |
Patent text — is the patent's own abstract consistent with the prediction?
For each of this compound's patents that has machine-readable text (9 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.
| Patent | Title | Text reads most about | Predicted target · text-rank |
|---|---|---|---|
| US-20240059710-A1 | KRAS G12D Inhibitors | KRAS, NRAS, HRAS | TSHR 3828/4885TYR 4685/4885HTT 3094/4885 |
| US-20110071299-A1 | One-Pot Preparation of Hexahydroisoquinolines from Amides | QARS1, QTRT1, SFPQ | TSHR 1956/4885TYR 588/4885HTT 102/4885 |
| US-20230081426-A1 | COMPOUNDS AND METHODS FOR KRAS MODULATION AND INDICATIONS THEREFOR | KRAS, NRAS, HRAS | TSHR 1685/4885TYR 3593/4885HTT 1337/4885 |
| US-20050239869-A1 | Novel process for the synthesis of 5-(4-fluorophenyl)-1-[2-((2R,4R)-4-hydroxy-6-oxo-tetrahydro-pyran-2-yl)-ethyl]-2-isopropyl-4-phenyl-1eta-pyrrole-3-carboxylic acid phenylamide | PAH, PCCA, HPD | TSHR 2998/4885TYR 322/4885HTT 951/4885 |
| US-20020133026-A1 | NOVEL PROCESS FOR THE SYNTHESIS OF 5-(4-FLUOROPHENYL)-1-[2-((2R,4R)-4-HYDROXY-6-OXO-TETRAHYDRO-PYRAN-2-YL)-ETHYL]-2-ISOPROPYL-4-PHENYL-1H-PYRROLE-3-CARBOXYLIC ACID PHENYLAMIDE | PCCA, PAH, HPD | TSHR 3366/4885TYR 520/4885HTT 1419/4885 |
| US-20070032664-A1 | Novel process for the synthesis of 5-(4-fluorophenyl)-1-[2-((2R,4R)-4-hydroxy-6-oxo-tetrahydro-pyran-2-yl)-ethyl]-2-isopropyl-4-phenyl-1H-pyrrole-3-carboxylic acid phenylamide | PAH, PCCA, HPD | TSHR 3413/4885TYR 473/4885HTT 1435/4885 |
| US-20130137874-A1 | One-Pot Preparation of Hexahydroisoquinolines from Amides | QARS1, QTRT1, SFPQ | TSHR 1956/4885TYR 588/4885HTT 102/4885 |
| US-20110071300-A1 | One-Pot Preparation of Hexahydroisoquinolines from Dihydroisoquinolines | QDPR, QTRT1, DHPS | TSHR 3399/4885TYR 456/4885HTT 50/4885 |
| US-20240025918-A1 | KRAS G12D Inhibitors | KRAS, NRAS, HRAS | TSHR 4206/4885TYR 4485/4885HTT 1987/4885 |
“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.