⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL14399205 | 0.73 | HCAR2 (0.35) | — | |
| SCHEMBL20828239 | 0.61 | — | — | |
| SCHEMBL30712008 | 0.58 | SMN1; SMN2 (0.38) | — | |
| SCHEMBL13021610 | 0.58 | NOS2 (0.38) | — | |
| SCHEMBL21062014 | 0.58 | SMN1; SMN2 (0.38) | — | |
| SCHEMBL13459871 | 0.58 | CCR1 (0.33) | — | |
| SCHEMBL8346362 | 0.56 | VHL (0.36) | — | |
| SCHEMBL15661581 | 0.56 | HTT (0.44) | — | |
| SCHEMBL13674908 | 0.56 | YTHDC1 (0.35) | — | |
| SCHEMBL13996732 | 0.56 | NNMT (0.55) | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20100216766-A1 | Inhibitors of VEGF Receptor and HGF Receptor Signalling | 92229129 QUEBEC INC. (CA) | 2010-08-26 | — | — | US | disclosed |