Known targets — ChEMBL curated mechanism
BTKCACNA1CCACNA1DCACNA1FCACNA1SCACNA2D1CACNA2D2DRD2GABRA1GABRA2GABRA3GABRA4GABRA5GABRA6GABRB1GABRB2GABRB3GABRDGABREGABRG1GABRG2GABRG3GABRPGABRQHRH1HTR2AP2RY12
The experimentally established mechanism targets of None. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 1.00 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 1.00 |
| ▸ | POLB | P06746 | 1/20 | 0.62 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.62 |
| ▸ | HTR6 | P50406 | 1/20 | 0.58 |
| ▸ | LMNA | P02545 | 1/20 | 0.57 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.55 |
| ▸ | NT5E | P21589 | 1/20 | 0.55 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.52 |
| ▸ | CA1 | P00915 | 2/20 | 0.52 |
| ▸ | CA2 | P00918 | 2/20 | 0.52 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.52 |
| ▸ | CA12 | O43570 | 1/20 | 0.52 |
| ▸ | CA3 | P07451 | 1/20 | 0.52 |
| ▸ | CA4 | P22748 | 1/20 | 0.52 |
| ▸ | CA6 | P23280 | 1/20 | 0.52 |
| ▸ | CA5A | P35218 | 1/20 | 0.52 |
| ▸ | CA7 | P43166 | 1/20 | 0.52 |
| ▸ | PLA2G7 | Q13093 | 1/20 | 0.52 |
| ▸ | CA9 | Q16790 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL3409457 | 1.00 | TSHR (1.00) | TSHRSMN1; SMN2POLBCYP2D6HTR6 | |
| Benzene SCHEMBL9751882 | 1.00 | TSHR (1.00) | TSHRSMN1; SMN2POLBCYP2D6HTR6 | |
| SCHEMBL1079321 | 1.00 | TSHR (1.00) | TSHRSMN1; SMN2POLBCYP2D6HTR6 | |
| SCHEMBL30307036 | 1.00 | TSHR (1.00) | TSHRSMN1; SMN2POLBCYP2D6HTR6 | |
| SCHEMBL597672 | 1.00 | TSHR (1.00) | TSHRSMN1; SMN2POLBCYP2D6HTR6 | |
| SCHEMBL2509 | 1.00 | TSHR (1.00) | TSHRSMN1; SMN2POLBCYP2D6HTR6 | |
| SCHEMBL30671620 | 1.00 | TSHR (1.00) | TSHRSMN1; SMN2POLBCYP2D6HTR6 | |
| SCHEMBL30812783 | 1.00 | TSHR (1.00) | TSHRSMN1; SMN2POLBCYP2D6HTR6 | |
| SCHEMBL9871011 | 0.97 | TSHR (0.94) | TSHRSMN1; SMN2POLBCYP2D6HTR6 | |
| Hydrochloric Acid SCHEMBL11436653 | 0.97 | TSHR (0.94) | TSHRSMN1; SMN2POLBCYP2D6HTR6 |
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 215 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20040039211-A1 | Tetrapyrroles | DUKE UNIVERSITY AND NATIONAL JEWISH MEDICAL AND RESEARCH CENTER | 2004-02-26 | — | — | US | claimed |
| EP-1320532-A1 | TETRAPYRROLES | DUKE UNIVERSITY (US) | 2003-06-25 | — | — | EP | claimed |
| US-20030069281-A1 | Tetrapyrroles | GOODNOW CAPITAL, L.L.C. | 2003-04-10 | — | — | US | claimed |
| WO-2001096345-A1 | TETRAPYRROLES | DUKE UNIVERSITY (US) | 2001-12-20 | — | — | WO | claimed |
| EP-1095043-A1 | TRIOXANE DERIVATIVES | The Hong Kong University of Science & Technology (HK) | 2001-05-02 | — | — | EP | claimed |
| WO-2000004026-A1 | TRIOXANE DERIVATIVES | THE HONG KONG UNIVERSITY OF SCIENCE & TECHNOLOGY (CN) | 2000-01-27 | — | — | WO | claimed |
| EP-0974593-A1 | Artemisinin derivatives as antiparasitic agents | The Hong Kong University of Science & Technology (HK) | 2000-01-26 | — | — | EP | claimed |
| CN-115885985-A | Aqueous suspension concentrates | FMC公司 | 2023-04-04 | — | — | CN | disclosed |
| CN-114745954-A | Liquid pesticide composition | 住友化学株式会社 | 2022-07-12 | — | — | CN | disclosed |
| WO-2020226890-A1 | POLYMERIZATION COMPOSITIONS AND METHODS FOR MAKING AND USING SAME | HANIK PETER (US) | 2020-11-12 | — | — | WO | disclosed |
| EP-0783022-B2 | ETHYLENIC POLYMER COMPOSITION | MITSUI CHEMICALS INC (JP) | 2016-01-20 | — | — | EP | disclosed |
| EP-1243598-B1 | PROCESS FOR THE POLYMERIZATION OF OLEFINS | MITSUI CHEMICALS INC (JP) | 2015-08-12 | — | — | EP | disclosed |
| EP-2267045-B1 | Olefin polymer of very low polydispersity and process for preparing the same | MITSUI CHEMICALS INC (JP) | 2015-07-15 | — | — | EP | disclosed |
| US-5504172-A | COORDINATION CATALYST | MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) | 1996-04-02 | — | — | US | disclosed |
| EP-0697419-A1 | Olefin polymerization catalyst and process for olefin polymerization | MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) | 1996-02-21 | — | — | EP | disclosed |
| EP-0691354-A1 | Unsaturated copolymer of ethylene and process for preparing the same | MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) | 1996-01-10 | — | — | EP | disclosed |
| EP-0682042-A1 | PROPYLENE ELASTOMER | MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) | 1995-11-15 | — | — | EP | disclosed |
| EP-0653433-A1 | Novel transition metal compound, olefin polymerization catalyst component comprising the transition metal compound, olefin polymerization catalyst comprising the olefin polymerization catalyst component, and process for olefin polymerization | MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) | 1995-05-17 | — | — | EP | disclosed |
| EP-0629632-A2 | Novel transition metal compound for use as a polymerization catalyst | MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) | 1994-12-21 | — | — | EP | disclosed |
| EP-0629631-A2 | Novel transition metal compound, and polymerization catalyst containing it | MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) | 1994-12-21 | — | — | EP | 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 (2 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-20030069281-A1 | Tetrapyrroles | PPOX, TXNRD2, PRDX5 | TSHR 1618/4885SMN1; SMN2 2016/4885POLB 2373/4885 |
| US-20040039211-A1 | Tetrapyrroles | PPOX, TXNRD2, PRDX5 | TSHR 1618/4885SMN1; SMN2 2016/4885POLB 2373/4885 |
“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.