Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | SCN4A | P35499 | 1/20 | 0.33 |
| ▸ | SCN5A | Q14524 | 1/20 | 0.33 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.33 |
| ▸ | BCHE | P06276 | 2/20 | 0.33 |
| ▸ | ACHE | P22303 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | PARP1 | P09874 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | RECQL | P46063 | 1/20 | 0.32 |
| ▸ | BLM | P54132 | 1/20 | 0.32 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL7520710 | 0.84 | DAO (0.31) | TSHRBCHE | |
| SCHEMBL10769983 | 0.72 | GPR84 (0.31) | — | |
| SCHEMBL7157768 | 0.63 | TRPA1 (0.35) | TSHRLMNAMAPK1SCN4ASCN5A | |
| SCHEMBL7157758 | 0.63 | TRPA1 (0.35) | TSHRLMNAMAPK1SCN4ASCN5A | |
| SCHEMBL1650430 | 0.63 | TSHR (0.33) | TSHRLMNAMAPK1SCN4ASCN5A | |
| Acetic Acid SCHEMBL11657145 | 0.63 | NOX1 (0.33) | BCHEHSD17B10 | |
| SCHEMBL2937188 | 0.62 | ACHE (0.36) | TSHRBCHEACHEPOLBCYP3A4 | |
| SCHEMBL8651466 | 0.61 | ALOX5 (0.38) | TSHRLMNABCHEACHEPOLB | |
| SCHEMBL348197 | 0.61 | — | — | |
| Water SCHEMBL19744946 | 0.59 | — | — |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1140896-A1 | BENZOTHIEPIN-ANILIDE DERIVATIVES, THEIR PRODUCTION AND THEIR USE FOR ANTAGONIZING CCR-5 | Takeda Chemical Industries, Ltd. (JP) | 2001-10-10 | — | — | EP | claimed |
| WO-2000037455-A1 | BENZOTHIEPIN-ANILIDE DERIVATIVES, THEIR PRODUCTION AND THEIR USE FOR ANTAGONIZING CCR-5 | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 2000-06-29 | — | — | WO | claimed |
| US-4379162-A | 1-Benzothiepin-4-carboxamides | CIBA-GEIGY CORPORATION (US) | 1983-04-05 | — | — | US | disclosed |
| US-4329357-A | ANTIINFLAMMATORY AND ANTIARTHRITIC AGENTS | CIBA-GEIGY CORPORATION (US) | 1982-05-11 | — | — | US | disclosed |
| US-4277484-A | ANTIINFLAMMATORY AGENTS | CIBA-GEIGY CORPORATION (US) | 1981-07-07 | — | — | US | disclosed |
| US-4226998-A | ANTIINFLAMMATORY AGENTS | CIBA-GEIGY CORPORATION (US) | 1980-10-07 | — | — | US | disclosed |
| US-4185109-A | ANTIINFLAMMATORY AGENTS | CIBA-GEIGY CORPORATION (US) | 1980-01-22 | — | — | US | disclosed |