SCHEMBL19906869

SCHEMBL19906869

COc1cn(Cc2cc(F)c(C)c(F)c2)c(Nc2cccc3[nH]c(C)cc23)nc1=O

nearest known ligand 0.85

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 20/20 0.85

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
SCHEMBL19906872 0.92 P2RX7 (1.00) P2RX7
SCHEMBL22420522 0.92 P2RX7 (1.00) P2RX7
SCHEMBL19907446 0.89 P2RX7 (1.00) P2RX7
SCHEMBL20107104 0.88 P2RX7 (1.00) P2RX7
SCHEMBL19906862 0.88 P2RX7 (0.86) P2RX7
SCHEMBL22420519 0.86 P2RX7 (1.00) P2RX7
SCHEMBL19907444 0.85 P2RX7 (1.00) P2RX7
SCHEMBL19907518 0.81 P2RX7 (0.80) P2RX7
SCHEMBL20106895 0.81 P2RX7 (0.69) P2RX7
SCHEMBL19906863 0.81 P2RX7 (0.85) P2RX7

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-3287443-A1 6-MEMBERED HETEROCYCLIC DERIVATIVE AND PHARMACEUTICAL COMPOSITION COMPRISING SAME Shionogi & Co., Ltd (JP) 2018-02-28 EP disclosed