Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 4/20 | 0.50 |
| ▸ | TSHR | P16473 | 4/20 | 0.50 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.50 |
| ▸ | ATM | Q13315 | 1/20 | 0.50 |
| ▸ | RECQL | P46063 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.45 |
| ▸ | CA2 | P00918 | 3/20 | 0.45 |
| ▸ | LMNA | P02545 | 3/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.41 |
| ▸ | PRSS2 | P07478 | 1/20 | 0.41 |
| ▸ | PRSS3 | P35030 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | BCL2L1 | Q07817 | 1/20 | 0.33 |
| ▸ | MMP9 | P14780 | 1/20 | 0.32 |
| ▸ | MMP8 | P22894 | 1/20 | 0.32 |
| ▸ | MMP14 | P50281 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL1274550 | 0.93 | CYP3A4 (0.46) | CYP3A4TSHRTDP1ATMRECQL | |
| SCHEMBL1275503 | 0.90 | CYP3A4 (0.43) | CYP3A4TSHRTDP1ATMRECQL | |
| SCHEMBL10685560 | 0.90 | CYP3A4 (0.53) | CYP3A4TSHRTDP1ATMRECQL | |
| SCHEMBL8990193 | 0.87 | CYP3A4 (0.47) | CYP3A4TSHRTDP1ATMRECQL | |
| SCHEMBL3500694 | 0.85 | CYP3A4 (0.47) | CYP3A4TSHRTDP1ATMRECQL | |
| SCHEMBL5873092 | 0.83 | TSHR (0.43) | CYP3A4TSHRTDP1ATMRECQL | |
| SCHEMBL10686451 | 0.81 | CYP3A4 (0.46) | CYP3A4TSHRTDP1ATMRECQL | |
| SCHEMBL27263495 | 0.81 | ALDH1A1 (0.48) | CYP3A4TSHRTDP1ATMRECQL | |
| SCHEMBL5930242 | 0.80 | CYP3A4 (0.70) | CYP3A4TSHRTDP1ATMRECQL | |
| SCHEMBL10449652 | 0.78 | CYP3A4 (0.52) | CYP3A4TSHRTDP1ATMRECQL |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0275832-B1 | PROCESS FOR THE PREPARATION OF MERCAPTOMETHYLPHENOLS | CIBA-GEIGY AG (CH) | 1991-10-16 | — | — | EP | disclosed |
| US-4874885-A | Process for the preparation of mercaptomethylphenols | CIBA-GEIGY CORPORATION (US) | 1989-10-17 | — | — | US | disclosed |