⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6170894 | 0.78 | — | — | |
| SCHEMBL95875 | 0.75 | — | — | |
| SCHEMBL11841402 | 0.75 | MEN1 (0.60) | — | |
| SCHEMBL12799428 | 0.75 | MEN1 (0.78) | — | |
| SCHEMBL11333738 | 0.73 | — | — | |
| SCHEMBL11336046 | 0.73 | — | — | |
| SCHEMBL606521 | 0.73 | — | — | |
| SCHEMBL11333794 | 0.73 | — | — | |
| SCHEMBL606520 | 0.73 | — | — | |
| SCHEMBL2032452 | 0.73 | — | — |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-103502226-A | Cycloalkenyl aryl derivatives for CETP inhibitors | CHONG KUN DANG PHARM CORP | 2014-01-08 | — | — | CN | claimed |
| EP-3275874-B1 | FUSED HETEROCYCLIC COMPOUND | TAKEDA PHARMACEUTICALS CO (JP) | 2019-10-30 | — | — | EP | disclosed |
| EP-3275874-A1 | FUSED HETEROCYCLIC COMPOUND | Takeda Pharmaceutical Company Limited (JP) | 2018-01-31 | — | — | EP | disclosed |
| CN-103502226-A | Cycloalkenyl aryl derivatives for CETP inhibitors | CHONG KUN DANG PHARM CORP | 2014-01-08 | — | — | CN | disclosed |
| CN-1829689-A | Phenylmethylamine derivatives | ZERIA PHARM CO LTD (JP) | 2006-09-06 | — | — | CN | disclosed |
| US-5990140-A | 2-ALKYL OR CYCLOALKYL-4-PHENYL-2-OXAZOLINE DERIVATIVES; PESTICIDES; INSECTICIDES; MITICIDES; LARVICIDES; LOW DOSAGE | BAYER AKTIENGESELLSCHAFT (DE) | 1999-11-23 | — | — | US | disclosed |
| EP-0831704-A1 | USE OF OXAZOLINES FOR COMBATTING ECTOPARASITES | BAYER AG (DE) | 1998-04-01 | — | — | EP | disclosed |
| WO-1996041534-A1 | USE OF OXAZOLINES FOR COMBATTING ECTOPARASITES | BAYER AKTIENGESELLSCHAFT (DE) | 1996-12-27 | — | — | WO | disclosed |