⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3421452 | 0.80 | — | — | |
| SCHEMBL3421445 | 0.78 | — | — | |
| SCHEMBL3417122 | 0.76 | — | — | |
| SCHEMBL3417123 | 0.76 | LMNA (0.35) | — | |
| SCHEMBL3419562 | 0.76 | LMNA (0.35) | — | |
| SCHEMBL31229943 | 0.73 | — | — | |
| SCHEMBL14732245 | 0.73 | — | — | |
| SCHEMBL17366121 | 0.73 | — | — | |
| SCHEMBL29197327 | 0.73 | — | — | |
| SCHEMBL31229822 | 0.71 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-20100130712-A1 | ADAMANTANE DERIVATIVE, RESIN COMPOSITION USING THE SAME, AND RESIN CURED PRODUCT | IDEMITSU KOSAN CO., LTD. (JP) | 2010-05-27 | — | — | US | disclosed |
| EP-0608991-B1 | Liquid crystalline polyesters | NIPPON OIL CO LTD (JP) | 1997-05-21 | — | — | EP | disclosed |
| US-5358661-A | Stable, soluble polymers from 4,4*-biphenyldicarboxylic acid, 2,6-naphthalenedicarboxylic acid and/or terephthalic acid, and substituted 1,4-butanediols | NIPPON OIL COMPANY, LIMITED (JP) | 1994-10-25 | — | — | US | disclosed |
| EP-0608991-A1 | Liquid crystalline polyesters | NIPPON OIL CO. LTD. (JP) | 1994-08-03 | — | — | EP | disclosed |