⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3122095 | 0.85 | PGR (0.30) | — | |
| SCHEMBL20703823 | 0.78 | MCHR1 (0.33) | — | |
| SCHEMBL158042 | 0.77 | — | — | |
| SCHEMBL440263 | 0.77 | MCHR1 (0.34) | — | |
| SCHEMBL3126463 | 0.76 | — | — | |
| SCHEMBL4793873 | 0.75 | — | — | |
| SCHEMBL11149147 | 0.75 | — | — | |
| SCHEMBL3544827 | 0.75 | LMNA (0.35) | — | |
| SCHEMBL8217121 | 0.75 | — | — | |
| SCHEMBL19405683 | 0.74 | TRPA1 (0.30) | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2010036316-A1 | UREA AND CARBAMATE COMPOUNDS AND ANALOGS AS KINASE INHIBITORS | FENG YANGBO (US) | 2010-04-01 | — | — | WO | claimed |
| WO-2010036316-A1 | UREA AND CARBAMATE COMPOUNDS AND ANALOGS AS KINASE INHIBITORS | FENG YANGBO (US) | 2010-04-01 | — | — | WO | disclosed |
| WO-2009137380-A1 | 3-HYDRAZONE PIPERAZINYL RIFAMYCIN DERIVATIVES USEFUL AS ANTIMICROBIAL AGENTS | JANSSEN PHARMACEUTICA NV (BE) | 2009-11-12 | — | — | WO | disclosed |
| US-7432264-B2 | Antimicrobial biaryl compounds | ISIS PHARMACEUTICALS, INC. (US) | 2008-10-07 | — | — | US | disclosed |
| US-20050032805-A1 | Antimicrobial biaryl compounds | ISIS PHARMACEUTICALS, INC. | 2005-02-10 | — | — | US | disclosed |