Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 1/20 | 0.53 |
| ▸ | TSHR | P16473 | 1/20 | 0.47 |
| ▸ | POLB | P06746 | 2/20 | 0.47 |
| ▸ | HPGD | P15428 | 4/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | PLOD2 | O00469 | 1/20 | 0.46 |
| ▸ | PLOD3 | O60568 | 1/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | PLOD1 | Q02809 | 1/20 | 0.46 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.45 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.45 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL8986684 | 0.85 | HTT (0.49) | HTTTSHRHPGDCYP3A4ALDH1A1 | |
| SCHEMBL390454 | 0.85 | HDAC1 (0.49) | HTTPOLBCYP3A4ALDH1A1CYP1A2 | |
| SCHEMBL24634852 | 0.85 | SRC (0.51) | POLBHPGDALDH1A1SMN1; SMN2KMT2A | |
| SCHEMBL31055006 | 0.81 | SMN1; SMN2 (0.54) | HPGDCYP3A4ALDH1A1CYP1A2CYP2D6 | |
| SCHEMBL16563433 | 0.78 | CYP19A1 (0.52) | HPGDTDP1HDAC1RAB9ANPC1 | |
| SCHEMBL7684019 | 0.78 | GSK3B (0.55) | HTTGSK3B | |
| SCHEMBL6763673 | 0.77 | CYP19A1 (0.59) | POLBHPGDCYP3A4ALDH1A1PLOD2 | |
| SCHEMBL1073206 | 0.77 | — | — | |
| SCHEMBL11234602 | 0.76 | TSHR (0.45) | HTTTSHRHDAC1HDAC6 | |
| SCHEMBL11234607 | 0.76 | TSHR (0.45) | HTTTSHRHDAC1HDAC6 |
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 16 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-118726999-A | Preparation method of phosphoryl azole acetophenone derivatives | 上海兆维科技发展有限公司 | 2024-10-01 | — | — | CN | disclosed |
| US-7390835-B2 | Aralkyl amines as cannabinoid receptor modulators | MERCK & CO., INC. (US) | 2008-06-24 | — | — | US | disclosed |
| US-7345080-B2 | Substituted 4-pyrazolyl pyrazonlines used for pest control | BAYER CROPSCIENCE AG (DE) | 2008-03-18 | — | — | US | disclosed |
| CN-100349891-C | Substituted 4-pyrazolyl pyrazolines for pest control agents | BAYER CROPSCIENCE AG (DE) | 2007-11-21 | — | — | CN | disclosed |
| US-20070088058-A1 | 3-(1(S)(4-chlorobenzyl)-2(S)-((2-hydroxy-2-methyl-1-phenylpropyl)amino)propyl)-benzonitrile; obesity; potentiation; antagonists | MERCK SHARP & DOHME CORP. | 2007-04-19 | — | — | US | disclosed |
| EP-1682494-A4 | ARALKYL AMINES AS CANNABINOID RECEPTOR MODULATORS | MERCK & CO INC (US) | 2006-11-08 | — | — | EP | disclosed |
| EP-1682494-A1 | ARALKYL AMINES AS CANNABINOID RECEPTOR MODULATORS | Merck & Co., Inc. (US) | 2006-07-26 | — | — | EP | disclosed |
| CN-1646523-A | Substituted 4-pyrazolyl pyrazolines for pest control agents | BAYER CROPSCIENCE AG (DE) | 2005-07-27 | — | — | CN | disclosed |
| US-20050159603-A1 | Substituted 4-pyrazolyl pyrazonlines used for pest control | BAYER CROPSCIENCE AG (DE) | 2005-07-21 | — | — | US | disclosed |
| WO-2005044785-A1 | ARALKYL AMINES AS CANNABINOID RECEPTOR MODULATORS | MERCK & CO., INC. (US) | 2005-05-19 | — | — | WO | disclosed |
| US-20050096354-A1 | Process for the preparation of substituted aryl pyrazoles | PFIZER, INC. (US) | 2005-05-05 | — | — | US | disclosed |
| EP-1478644-A1 | SUBSTITUTED 4-PYRAZOLYL PYRAZOLINES USED FOR PEST CONTROL | Bayer CropScience AG (DE) | 2004-11-24 | — | — | EP | disclosed |
| WO-2003070724-A1 | SUBSTITUTED 4-PYRAZOLYL PYRAZOLINES USED FOR PEST CONTROL | BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) | 2003-08-28 | — | — | WO | disclosed |
| EP-1000062-A1 | TRICYCLIC VASOPRESSIN AGONISTS | AMERICAN HOME PRODUCTS CORPORATION (US) | 2000-05-17 | — | — | EP | disclosed |
| WO-1999006409-A1 | TRICYCLIC VASOPRESSIN AGONISTS | AMERICAN HOME PRODUCTS CORPORATION (US) | 1999-02-11 | — | — | WO | disclosed |
| US-4239901-A | ANALGESICS, ANTIPYRETICS, ANTIINFLAMMATORY AGENTS | BYK GULDEN LOMBERG CHEMISCHE FABRIK GMBH (DE) | 1980-12-16 | — | — | 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 (3 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-20050096354-A1 | Process for the preparation of substituted aryl pyrazoles | CYP3A5, DDT, CYP3A4 | HTT 2381/4885TSHR 1270/4885POLB 3822/4885 |
| US-20050159603-A1 | Substituted 4-pyrazolyl pyrazonlines used for pest control | L3MBTL4, L3MBTL3, PTMS | HTT 4419/4885TSHR 1276/4885POLB 4747/4885 |
| US-20070088058-A1 | 3-(1(S)(4-chlorobenzyl)-2(S)-((2-hydroxy-2-methyl-1-phenylpropyl)amino)propyl)-benzonitrile; obesity; potentiation; antagonists | CNR2, CNR1, CHRNA4 | HTT 1633/4885TSHR 1336/4885POLB 1031/4885 |
“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.