SCHEMBL22341864

SCHEMBL22341864

C#COc1cc(C)c2nc(-c3cc(C)cc4nc(OC)cnc34)sc2c1

nearest known ligand 0.66

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
F2RL3 Q96RI0 19/20 0.66
CYP3A4 P08684 1/20 0.41

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

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.

Compoundsimilaritytop predictedshared targets
SCHEMBL21395756 0.89 F2RL3 (0.80) F2RL3
SCHEMBL30187700 0.89 F2RL3 (0.80) F2RL3
SCHEMBL22341875 0.88 F2RL3 (0.52) F2RL3CYP3A4
SCHEMBL22341909 0.87 F2RL3 (0.67) F2RL3
SCHEMBL22341937 0.86 F2RL3 (0.52) F2RL3
SCHEMBL22341907 0.83 F2RL3 (0.50) F2RL3
SCHEMBL19783420 0.83 F2RL3 (0.66) F2RL3
SCHEMBL22341906 0.82 F2RL3 (0.54) F2RL3
SCHEMBL19783159 0.82 F2RL3 (0.63) F2RL3
SCHEMBL19782809 0.81 F2RL3 (0.64) F2RL3

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.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3484878-B1 BICYCLIC HETEROARYL SUBSTITUTED COMPOUNDS BRISTOL MYERS SQUIBB CO (US) 2020-08-19 EP claimed