⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.
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 | |
|---|---|---|---|---|
| SCHEMBL27810504 | 0.72 | TDP1 (0.55) | — | |
| SCHEMBL30275983 | 0.70 | — | — | |
| SCHEMBL1829375 | 0.70 | — | — | |
| SCHEMBL27639135 | 0.70 | — | — | |
| SCHEMBL437702 | 0.70 | — | — | |
| SCHEMBL28228690 | 0.70 | — | — | |
| SCHEMBL31295418 | 0.68 | — | — | |
| SCHEMBL4722330 | 0.67 | — | — | |
| SCHEMBL8623919 | 0.64 | — | — | |
| Phenol SCHEMBL7190520 | 0.63 | CA12 (0.39) | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0705922-B1 | Production of colored silk filament | DAINICHISEIKA COLOR CHEM (JP) | 1998-06-03 | — | — | EP | disclosed |
| US-5538519-A | Production of colored silk filament | DAINICHISEIKA COLOR & CHEMICALS MFG. CO., LTD. (JP) | 1996-07-23 | — | — | US | disclosed |
| EP-0705922-A1 | Production of colored silk filament | DAINICHISEIKA COLOR & CHEMICALS MFG. CO. LTD. (JP) | 1996-04-10 | — | — | EP | disclosed |