⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5246594 | 0.78 | APLNR (0.41) | — | |
| SCHEMBL11260869 | 0.78 | APLNR (0.41) | — | |
| SCHEMBL3385056 | 0.78 | APLNR (0.41) | — | |
| SCHEMBL10886248 | 0.73 | — | — | |
| SCHEMBL10886237 | 0.73 | — | — | |
| SCHEMBL27636036 | 0.73 | — | — | |
| SCHEMBL2832388 | 0.73 | — | — | |
| SCHEMBL3152763 | 0.73 | — | — | |
| SCHEMBL2832390 | 0.73 | — | — | |
| SCHEMBL14713769 | 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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0973720-A1 | 2-SUBSTITUTED BENZOYL-CYCLOALKYL-1-CARBOXYLIC ACID DERIVATIVES | PHARMACIA & UPJOHN S.p.A. (IT) | 2000-01-26 | — | — | EP | disclosed |
| WO-1998040344-A1 | 2-SUBSTITUTED BENZOYL-CYCLOALKYL-1-CARBOXYLIC ACID DERIVATIVES | PHARMACIA & UPJOHN S.P.A. (IT) | 1998-09-17 | — | — | WO | disclosed |