⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL20129902 | 0.71 | — | — | |
| SCHEMBL8656998 | 0.70 | PDCD1 (0.43) | — | |
| SCHEMBL4134871 | 0.70 | KDM4E (0.33) | — | |
| SCHEMBL13841438 | 0.65 | — | — | |
| SCHEMBL862533 | 0.64 | — | — | |
| SCHEMBL30366318 | 0.64 | GABRA1 (0.40) | — | |
| SCHEMBL11844587 | 0.64 | IDO1 (0.36) | — | |
| SCHEMBL3414808 | 0.64 | GABRA1 (0.40) | — | |
| SCHEMBL15896844 | 0.60 | NQO1 (0.35) | — | |
| SCHEMBL95192 | 0.60 | HRH3 (0.40) | — |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7582712-B1 | Alpha-olefins polymerization catalyst | FORMOSA PLASTICS CORPORATION, U.S.A. (US) | 2009-09-01 | — | — | US | claimed |
| US-7582712-B1 | Alpha-olefins polymerization catalyst | FORMOSA PLASTICS CORPORATION, U.S.A. (US) | 2009-09-01 | — | — | US | disclosed |
| US-20060194969-A1 | 4-Substituted benzimidazoles and their uses as inhibitors of gastric secretion | ALTANA PHARMA AG (DE) | 2006-08-31 | — | — | US | disclosed |
| EP-1575924-A1 | 4-SUBSTITUTED BENZIMIDAZOLES AND THEIR USE AS INHIBITORS OF GASTRIC SECRETION | ALTANA Pharma AG (DE) | 2005-09-21 | — | — | EP | disclosed |
| WO-2004054984-A1 | 4-SUBSTITUTED BENZIMIDAZOLES AND THEIR USE AS INHIBITORS OF GASTRIC SECRETION | ALTANA PHARMA AG (DE) | 2004-07-01 | — | — | WO | disclosed |
| EP-0008665-B1 | FURYL-NONATETRAENE DERIVATIVES AND THE PHARMACEUTICALLY ACCEPTABLE SALTS THEREOF, PROCESSES FOR THEIR PREPARATION, STARTING COMPOUNDS USED IN THESE PROCESSES, AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM | F. HOFFMANN-LA ROCHE & CO. Aktiengesellschaft (CH) | 1983-06-15 | — | — | EP | disclosed |
| US-4216312-A | ANTITUMOR AGENTS, TREATMENT OF ACNE AND PSORIASIS | HOFFMANN-LA ROCHE INC. (US) | 1980-08-05 | — | — | US | disclosed |
| EP-0008665-A1 | Furyl-nonatetraene derivatives and the pharmaceutically acceptable salts thereof, processes for their preparation, starting compounds used in these processes, and pharmaceutical compositions containing them | F. HOFFMANN-LA ROCHE & CO. Aktiengesellschaft (CH) | 1980-03-19 | — | — | EP | disclosed |