Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | ATM | Q13315 | 1/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
| ▸ | MCL1 | Q07820 | 5/20 | 0.42 |
| ▸ | MRGPRX4 | Q96LA9 | 2/20 | 0.40 |
| ▸ | EPAS1 | Q99814 | 1/20 | 0.40 |
| ▸ | ALK | Q9UM73 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | USP2 | O75604 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | CA1 | P00915 | 1/20 | 0.39 |
| ▸ | CA2 | P00918 | 1/20 | 0.39 |
| ▸ | CA9 | Q16790 | 1/20 | 0.39 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL8500197 | 0.83 | EPAS1 (0.40) | ALDH1A1MCL1MRGPRX4EPAS1HSD11B1 | |
| SCHEMBL7597732 | 0.81 | CES2 (0.43) | ALDH1A1KMT2AEPAS1KDM4EUSP2 | |
| SCHEMBL28741529 | 0.81 | EPAS1 (0.41) | ALDH1A1MEN1KMT2AMRGPRX4EPAS1 | |
| SCHEMBL12035597 | 0.80 | EPAS1 (0.33) | MEN1KMT2AEPAS1CA1CA2 | |
| SCHEMBL7599616 | 0.78 | RXRA (0.47) | ALDH1A1MEN1KMT2AEPAS1KDM4E | |
| SCHEMBL16737197 | 0.78 | ALDH1A1 (0.61) | ALDH1A1MEN1KMT2AMRGPRX4KDM4E | |
| SCHEMBL8004806 | 0.78 | CA12 (0.39) | ALDH1A1TSHRL3MBTL1EPAS1MAPT | |
| SCHEMBL31265222 | 0.75 | PTGS2 (0.43) | ALDH1A1KMT2AEPAS1KDM4EMAPT | |
| SCHEMBL5599422 | 0.75 | PTGS2 (0.43) | ALDH1A1KMT2AEPAS1KDM4EMAPT | |
| SCHEMBL2269588 | 0.75 | PDE2A (0.43) | ALDH1A1MEN1TSHRKMT2AATM |
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 14 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1154993-B1 | THIOAMIDE DERIVATIVES | HOFFMANN LA ROCHE (CH) | 2004-10-06 | — | — | EP | disclosed |
| US-6479666-B2 | ANTIINFLAMMATORY AGENTS | HOFFMAN-LA ROCHE INC. | 2002-11-12 | — | — | US | disclosed |
| US-6458844-B2 | ANTIINFLAMMATORY AGENTS | HOFFMANN-LA ROCHE INC. | 2002-10-01 | — | — | US | disclosed |
| US-6426348-B1 | FOR THERAPY OF INFLAMMATION ASSOCIATED WITH CHRONIC INFLAMMATORY DISEASES SUCH AS RHEUMATOID ARTHRITIS (RA), MULTIPLE SCLEROSIS, (MS), ASTHMA, AND INFLAMMATORY BOWEL DISEASE (I BD) | HOFFMANN-LA ROCHE INC. | 2002-07-30 | — | — | US | disclosed |
| US-6423728-B1 | INHIBIT BINDING OF VASCULAR CELL ADHESION MOLECULE-1 (VCAM-1) TO THE INTEGRIN VLA-4; USE AS ANTIINFLAMMATORY AGENTS AGAINST RHEMATOID ARTHRITIS, MULTIPLE SCLEROSIS, INFLAMMATORY BOWEL DISEASE AND ASTHMA | HOFFMAN-LA ROCHE INC. | 2002-07-23 | — | — | US | disclosed |
| US-20020052508-A1 | Heterocyclic thioamide derivatives | HULL KENNETH G (US) | 2002-05-02 | — | — | US | disclosed |
| US-20020040148-A1 | Diphenyl heterocyclic thioamide derivatives | HULL KENNETH G (US) | 2002-04-04 | — | — | US | disclosed |
| CN-1342140-A | Thioamide derivatives | HOFFMANN LA ROCHE (CH) | 2002-03-27 | — | — | CN | disclosed |
| US-20020028933-A1 | Thioamide derivatives | HULL KENNETH GREGORY (US) | 2002-03-07 | — | — | US | disclosed |
| US-20020010338-A1 | PHENYL-KETO-IMIDAZOLIDINE THIOAMIDE DERIVATIVES | HULL KENNETH G (US) | 2002-01-24 | — | — | US | disclosed |
| EP-1154993-A1 | THIOAMIDE DERIVATIVES | F. HOFFMANN-LA ROCHE AG (CH) | 2001-11-21 | — | — | EP | disclosed |
| US-20010041799-A1 | Diephenyl carbocyclic thioamide derivatives | HULL KENNETH G (US) | 2001-11-15 | — | — | US | disclosed |
| US-6288267-B1 | AROMATIC CARBOXY THIOAMIDES WITH AMIDES AS DRUGS TO COUNTERACT INFLAMMATION | HOFFMANN-LA ROCHE INC. | 2001-09-11 | — | — | US | disclosed |
| WO-2000048994-A1 | THIOAMIDE DERIVATIVES | F. HOFFMANN-LA ROCHE AG (CH) | 2000-08-24 | — | — | WO | 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 (5 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-20020028933-A1 | Thioamide derivatives | VCAM1, ICAM1, LTB4R | ALDH1A1 153/4885MEN1 4163/4885TSHR 706/4885 |
| US-20020010338-A1 | PHENYL-KETO-IMIDAZOLIDINE THIOAMIDE DERIVATIVES | VCAM1, ICAM1, KCNA4 | ALDH1A1 243/4885MEN1 4461/4885TSHR 1614/4885 |
| US-20020040148-A1 | Diphenyl heterocyclic thioamide derivatives | VCAM1, ICAM1, LTB4R | ALDH1A1 118/4885MEN1 4244/4885TSHR 944/4885 |
| US-20010041799-A1 | Diephenyl carbocyclic thioamide derivatives | VCAM1, ICAM1, LTB4R | ALDH1A1 232/4885MEN1 4115/4885TSHR 778/4885 |
| US-20020052508-A1 | Heterocyclic thioamide derivatives | VCAM1, ICAM1, LTB4R | ALDH1A1 153/4885MEN1 3815/4885TSHR 797/4885 |
“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.