⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL22637 | 0.85 | — | — | |
| SCHEMBL20819505 | 0.80 | — | — | |
| Hydrochloric Acid SCHEMBL1500349 | 0.80 | — | — | |
| SCHEMBL5800562 | 0.80 | — | — | |
| Hydrochloric Acid SCHEMBL9538 | 0.80 | — | — | |
| SCHEMBL8019633 | 0.80 | — | — | |
| SCHEMBL7397825 | 0.80 | — | — | |
| SCHEMBL28613908 | 0.76 | — | — | |
| Hydrochloric Acid SCHEMBL1763117 | 0.76 | — | — | |
| Hydrochloric Acid SCHEMBL428354 | 0.76 | — | — |
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-0661259-B1 | Substituted (5,6)-dihydronaphthalenyl compounds having retinoid-like activity | BRISTOL MYERS SQUIBB CO (US) | 1997-10-08 | — | — | EP | disclosed |
| US-5648385-A | TREATING RHEUMATOID ARTHRITIS | BRISTOL-MYERS SQUIBB CO. (US) | 1997-07-15 | — | — | US | disclosed |
| EP-0661259-A1 | Substituted (5,6)-dihydronaphthalenyl compounds having retinoid-like activity | BRISTOL-MYERS SQUIBB COMPANY (US) | 1995-07-05 | — | — | EP | disclosed |