⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1069998 | 0.78 | — | — | |
| SCHEMBL4582121 | 0.78 | TSHR (0.39) | — | |
| SCHEMBL18691857 | 0.77 | MEN1 (0.32) | — | |
| SCHEMBL12820348 | 0.76 | — | — | |
| SCHEMBL20996792 | 0.76 | — | — | |
| SCHEMBL731115 | 0.76 | — | — | |
| SCHEMBL28160799 | 0.75 | — | — | |
| SCHEMBL23086024 | 0.73 | — | — | |
| SCHEMBL20191384 | 0.73 | — | — | |
| SCHEMBL19506797 | 0.73 | — | — |
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-7186782-B2 | Hydrogenation catalyst composition and process for hydrogenation of conjugated diene polymer | TSRC CORPORATION (TW) | 2007-03-06 | — | — | US | disclosed |
| US-20060041079-A1 | Hydrogenation catalyst composition and process for hydrogenation of conjugated diene polymer | TSRC CORPORATION | 2006-02-23 | — | — | US | disclosed |
| EP-1539663-A1 | PROCESS FOR PRODUCTION OF AN ALCOHOL | JOHNSON MATTHEY PUBLIC LIMITED COMPANY (GB) | 2005-06-15 | — | — | EP | disclosed |
| US-6881797-B2 | Process for hydrogenation of conjugated diene polymer | TSRC CORPORATION (TW) | 2005-04-19 | — | — | US | disclosed |
| US-20040082727-A1 | Process for hydrogenation of conjugated diene polymer | TSRC CORPORATION (CN) | 2004-04-29 | — | — | US | disclosed |
| WO-2004026800-A1 | PROCESS FOR PRODUCTION OF AN ALCOHOL | JOHNSON MATTHEY PLC (GB) | 2004-04-01 | — | — | WO | disclosed |