⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL25863028 | 0.82 | — | — | |
| SCHEMBL12689860 | 0.82 | KDM4E (0.31) | — | |
| SCHEMBL25259657 | 0.80 | — | — | |
| SCHEMBL25863096 | 0.80 | KDM4E (0.34) | — | |
| SCHEMBL6879181 | 0.80 | VCP (0.31) | — | |
| SCHEMBL2238115 | 0.80 | — | — | |
| SCHEMBL6740109 | 0.78 | VCP (0.30) | — | |
| SCHEMBL8136053 | 0.78 | TAS1R3 (0.30) | — | |
| SCHEMBL10482474 | 0.78 | KDM4E (0.31) | — | |
| SCHEMBL3808932 | 0.77 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-8124629-B2 | Naphthylacetic acids | HOFFMANN-LA ROCHE INC. (US) | 2012-02-28 | — | — | US | disclosed |
| US-20100137250-A1 | NAPHTHYLACETIC ACIDS | FIROOZNIA FARIBORZ | 2010-06-03 | — | — | US | disclosed |
| EP-0365149-A2 | Leukotriene antagonist prodrugs | SMITHKLINE BEECHAM CORPORATION (US) | 1990-04-25 | — | — | EP | disclosed |