⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL18557263 | 0.73 | HSD17B10 (0.35) | — | |
| SCHEMBL408779 | 0.67 | — | — | |
| SCHEMBL2769165 | 0.65 | — | — | |
| SCHEMBL2807011 | 0.65 | — | — | |
| SCHEMBL9715318 | 0.65 | — | — | |
| SCHEMBL17641604 | 0.64 | EPHX1 (0.36) | — | |
| SCHEMBL5369459 | 0.62 | — | — | |
| SCHEMBL16021835 | 0.62 | — | — | |
| SCHEMBL12217162 | 0.62 | — | — | |
| SCHEMBL4550236 | 0.61 | KDM4E (0.30) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-4148905-A | PREVENTING OR RETARDING GROWTH OF BACTERIA OR FUNGI | STERLING DRUG INC. (US) | 1979-04-10 | — | — | US | claimed |
| US-20120142853-A1 | NOVEL PHENOLIC RESINS | SWEDO RAYMOND J (US) | 2012-06-07 | — | — | US | disclosed |
| US-20120142853-A1 | NOVEL PHENOLIC RESINS | SWEDO RAYMOND J (US) | 2012-06-07 | — | — | US | disclosed |
| US-7319131-B2 | Phenolic resins | ANGUS CHEMICAL COMPANY (US) | 2008-01-15 | — | — | US | disclosed |
| US-7319131-B2 | Phenolic resins | ANGUS CHEMICAL COMPANY (US) | 2008-01-15 | — | — | US | disclosed |
| US-4178375-A | ANTIBACTERIAL, ANTIFUNGAL | STERLING DRUG INC. (US) | 1979-12-11 | — | — | US | disclosed |
| US-4148905-A | PREVENTING OR RETARDING GROWTH OF BACTERIA OR FUNGI | STERLING DRUG INC. (US) | 1979-04-10 | — | — | US | disclosed |