SCHEMBL19907753

SCHEMBL19907753

Cc1nc2cc(C)c(Nc3nc(=O)c(CCO)cn3Cc3cc(F)c(F)c(F)c3)c(C)c2s1

nearest known ligand 0.73

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 20/20 0.73

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
SCHEMBL22420554 0.84 P2RX7 (1.00) P2RX7
SCHEMBL19907336 0.75 P2RX7 (0.69) P2RX7
SCHEMBL19907835 0.74 P2RX7 (1.00) P2RX7
SCHEMBL19907770 0.74 P2RX7 (1.00) P2RX7
SCHEMBL19907512 0.72 P2RX7 (1.00) P2RX7
SCHEMBL19906502 0.72 P2RX7 (0.81) P2RX7
SCHEMBL19907432 0.69 P2RX7 (0.77) P2RX7
SCHEMBL19907931 0.68 P2RX7 (1.00) P2RX7
SCHEMBL19907360 0.68 P2RX7 (0.73) P2RX7
SCHEMBL19908110 0.67 P2RX7 (0.80) 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