⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL397845 | 0.85 | — | — | |
| SCHEMBL398839 | 0.85 | — | — | |
| SCHEMBL397678 | 0.79 | — | — | |
| SCHEMBL3465318 | 0.78 | DNM1 (0.35) | — | |
| SCHEMBL19532756 | 0.76 | OPRM1 (0.42) | — | |
| SCHEMBL7146673 | 0.76 | HTR2A (0.32) | — | |
| SCHEMBL28749865 | 0.76 | ENPEP (0.32) | — | |
| SCHEMBL9698390 | 0.74 | NFKB1 (0.32) | — | |
| SCHEMBL3312385 | 0.74 | OPRM1 (0.41) | — | |
| SCHEMBL400172 | 0.74 | LMNA (0.34) | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-105593234-B | Novel organopolysiloxane, the surface conditioning agent comprising it, the resin combination comprising it and their gel-like product or cured product | 道康宁东丽株式会社 | 2018-10-26 | — | — | CN | disclosed |
| CN-105593234-A | Novel organopolysiloxane, surface treatment agent comprising the same, resin composition comprising the same, and gelatinous product or cured product thereof | DOW CORNING TORAY CO LTD | 2016-05-18 | — | — | CN | disclosed |