⚠ 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 | |
|---|---|---|---|---|
| Methane SCHEMBL10661901 | 1.00 | — | — | |
| SCHEMBL1316 | 0.96 | — | — | |
| SCHEMBL1367755 | 0.96 | MEN1 (0.36) | — | |
| SCHEMBL5974095 | 0.93 | — | — | |
| SCHEMBL5974365 | 0.93 | — | — | |
| SCHEMBL11420864 | 0.92 | — | — | |
| Hydrochloric Acid SCHEMBL904358 | 0.92 | — | — | |
| SCHEMBL11135693 | 0.92 | — | — | |
| Hydrochloric Acid SCHEMBL2792838 | 0.92 | — | — | |
| SCHEMBL8565203 | 0.92 | — | — |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4727076-A | ANTIHISTAMINES | SMITH KLINE & FRENCH LABORATORIES LTD. (GB) | 1988-02-23 | — | — | US | claimed |
| US-5763461-A | ANTIPICORNAVIRAL AGENTS | SANOFI (FR) | 1998-06-09 | — | — | US | disclosed |
| US-5618821-A | VIRICIDES, PICORNAVIRUS | SANOFI, S.A. (FR) | 1997-04-08 | — | — | US | disclosed |
| WO-1995031438-A1 | THERAPEUTIC PHENOXYALKYLHETEROCYCLES | SANOFI WINTHROP, INC. (US) | 1995-11-23 | — | — | WO | disclosed |
| CN-1030582-A | 1-benzopyran derivatives | HOFFMANN LA ROCHE (CH) | 1989-01-25 | — | — | CN | disclosed |
| US-4727076-A | ANTIHISTAMINES | SMITH KLINE & FRENCH LABORATORIES LTD. (GB) | 1988-02-23 | — | — | US | disclosed |