⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2772489 | 0.82 | GSK3A (0.36) | — | |
| SCHEMBL5966287 | 0.81 | — | — | |
| SCHEMBL3881256 | 0.78 | — | — | |
| SCHEMBL7533382 | 0.78 | — | — | |
| SCHEMBL11757475 | 0.78 | — | — | |
| SCHEMBL7529056 | 0.78 | — | — | |
| SCHEMBL2133958 | 0.75 | GSK3A (0.31) | — | |
| SCHEMBL3873607 | 0.75 | GSK3A (0.31) | — | |
| SCHEMBL5941211 | 0.75 | GSK3A (0.31) | — | |
| SCHEMBL7894436 | 0.73 | AKR1B1 (0.33) | — |
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-0434848-B1 | POLYCARBONATE-POLYDIMETHYLSILOXANE COPOLYMER AND METHOD OF PRODUCTION THEREOF | IDEMITSU PETROCHEMICAL CO (JP) | 1995-09-20 | — | — | EP | claimed |
| EP-0434848-B1 | POLYCARBONATE-POLYDIMETHYLSILOXANE COPOLYMER AND METHOD OF PRODUCTION THEREOF | IDEMITSU PETROCHEMICAL CO (JP) | 1995-09-20 | — | — | EP | disclosed |