Predicted protein targets (top 2)
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 | |
|---|---|---|---|---|
| SCHEMBL5671427 | 0.79 | NOS3 (0.43) | ESR1ESR2 | |
| SCHEMBL6993506 | 0.76 | KDM4E (0.34) | ESR1ESR2 | |
| SCHEMBL7985549 | 0.74 | MAPT (0.43) | ESR1ESR2 | |
| SCHEMBL7989336 | 0.74 | MAPT (0.43) | ESR1ESR2 | |
| Hydrochloric Acid SCHEMBL7980991 | 0.73 | MAPT (0.42) | ESR1ESR2 | |
| SCHEMBL7982265 | 0.71 | NOS3 (0.33) | — | |
| SCHEMBL7002022 | 0.70 | NOS3 (0.43) | ESR1ESR2 | |
| SCHEMBL7708358 | 0.70 | ALDH1A1 (0.43) | — | |
| SCHEMBL6611984 | 0.68 | PARP1 (0.45) | — | |
| SCHEMBL6991149 | 0.68 | NOS3 (0.48) | ESR1ESR2 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0980362-B1 | SUBSTITUTED HETEROCYCLES AND THEIR USE IN MEDICAMENTS | SCHERING AG (DE) | 2006-08-16 | — | — | EP | disclosed |
| US-6191127-B1 | ANTIINFLAMMATORY AGENTS, AUTOIMMUNE DISEASES, CARDIOVASCULAR DISORDERS, NERVOUS SYSTEM DISORDERS | SCHERING AKTIENGESELLSCHAFT (DE) | 2001-02-20 | — | — | US | disclosed |
| EP-0980362-A1 | SUBSTITUTED HETEROCYCLES AND THEIR USE IN MEDICAMENTS | SCHERING AKTIENGESELLSCHAFT (DE) | 2000-02-23 | — | — | EP | disclosed |
| WO-1998050372-A1 | SUBSTITUTED HETEROCYCLES AND THEIR USE IN MEDICAMENTS | SCHERING AKTIENGESELLSCHAFT (DE) | 1998-11-12 | — | — | WO | disclosed |