⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL24452271 | 0.81 | CPT1A (0.32) | — | |
| SCHEMBL24259620 | 0.79 | — | — | |
| SCHEMBL24259603 | 0.77 | TSHR (0.36) | — | |
| SCHEMBL24602575 | 0.69 | PIK3CG (0.39) | — | |
| SCHEMBL24452460 | 0.69 | HDAC4 (0.41) | — | |
| SCHEMBL24259360 | 0.68 | PIK3CG (0.33) | — | |
| SCHEMBL24259585 | 0.67 | PIK3CG (0.33) | — | |
| SCHEMBL24259044 | 0.66 | PIK3CG (0.34) | — | |
| SCHEMBL5616030 | 0.64 | CASP1 (0.38) | — | |
| SCHEMBL24452144 | 0.62 | GAA (0.41) | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-11713312-B2 | Substituted bicyclic compounds as farnesoid X receptor modulators | BRISTOL-MYERS SQUIBB COMPANY (US) | 2023-08-01 | — | — | US | disclosed |
| US-20220135550-A1 | SUBSTITUTED BICYCLIC COMPOUNDS AS FARNESOID X RECEPTOR MODULATORS | BRISTOL MYERS SQUIBB CO (US) | 2022-05-05 | — | — | US | disclosed |
| US-11254663-B2 | Substituted bicyclic compounds as farnesoid X receptor modulators | BRISTOL-MYERS SQUIBB COMPANY (US) | 2022-02-22 | — | — | US | disclosed |