⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL20956896 | 0.78 | FHIT (0.32) | — | |
| SCHEMBL3139352 | 0.74 | P2RX7 (0.35) | — | |
| SCHEMBL22237524 | 0.70 | — | — | |
| SCHEMBL6569507 | 0.69 | P2RX7 (0.30) | — | |
| SCHEMBL4032065 | 0.69 | MEN1 (0.33) | — | |
| SCHEMBL23747631 | 0.67 | CRBN (0.31) | — | |
| SCHEMBL531209 | 0.66 | — | — | |
| SCHEMBL20733168 | 0.66 | GBA1 (0.44) | — | |
| SCHEMBL10543893 | 0.66 | KMT2A (0.35) | — | |
| SCHEMBL8683030 | 0.66 | ALOX5 (0.42) | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2405997-A2 | VINYL POLYMER WETTING AND DISPERSING AGENTS | Valspar Sourcing, Inc. (US) | 2012-01-18 | — | — | EP | disclosed |
| WO-2010105219-A2 | VINYL POLYMER WETTING AND DISPERSING AGENTS | VALSPAR SOURCING, INC. (US) | 2010-09-16 | — | — | WO | disclosed |