⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4533453 | 0.92 | LMNA (0.34) | — | |
| SCHEMBL4757898 | 0.69 | — | — | |
| SCHEMBL21737534 | 0.69 | ALDH1A1 (0.35) | — | |
| SCHEMBL21218756 | 0.64 | LMNA (0.38) | — | |
| SCHEMBL674220 | 0.62 | LMNA (0.42) | — | |
| SCHEMBL12360362 | 0.62 | CA2 (0.36) | — | |
| SCHEMBL19355006 | 0.61 | — | — | |
| SCHEMBL2966677 | 0.58 | LMNA (0.37) | — | |
| SCHEMBL17240318 | 0.58 | GSK3B (0.30) | — | |
| SCHEMBL917122 | 0.58 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| JP-2202514-A | — | — | None | — | — | JP | disclosed |
| US-5247062-A | Hetero-aromatic polymer containing fluoroalkyl group | NIPPON OIL AND FATS CP., LTD. (JP) | 1993-09-21 | — | — | US | disclosed |
| EP-0414906-A1 | FLUOROALKYLATED HETEROAROMATIC POLYMER | NIPPON OIL AND FATS COMPANY, LIMITED (JP) | 1991-03-06 | — | — | EP | disclosed |
| JP-H02202514-A | HETEROAROMATIC POLYMER CONTAINING FLUOROALKYL GROUP | NIPPON OIL & FATS CO LTD | 1990-08-10 | — | — | JP | disclosed |