SCHEMBL22341968

SCHEMBL22341968

CCOc1cnc2c(-c3nc4cc(F)c(O[C@@H](C)[C@@H](C)OC(=O)Nc5cnc(CCC(=O)O)nc5)cc4s3)cc(C)cc2n1

nearest known ligand 0.59

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
F2RL3 Q96RI0 20/20 0.59

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
SCHEMBL22341970 1.00 F2RL3 (0.59) F2RL3
SCHEMBL21379655 0.94 F2RL3 (0.58) F2RL3
SCHEMBL21379656 0.94 F2RL3 (0.58) F2RL3
SCHEMBL31113851 0.93 F2RL3 (0.64) F2RL3
SCHEMBL21395918 0.93 F2RL3 (0.64) F2RL3
SCHEMBL31113801 0.92 F2RL3 (0.61) F2RL3
SCHEMBL19783048 0.92 F2RL3 (0.61) F2RL3
SCHEMBL19783463 0.91 F2RL3 (0.69) F2RL3
SCHEMBL31113820 0.91 F2RL3 (0.69) F2RL3
SCHEMBL31113627 0.91 F2RL3 (0.57) 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