SCHEMBL18166301

SCHEMBL18166301

Cc1ccc(-c2cc(OC(=O)NC(C)c3cnccn3)cc(-n3cnnn3)c2)c(F)c1

nearest known ligand 0.51

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
P2RX3 P56373 8/20 0.51
P2RX2 Q9UBL9 8/20 0.51

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
SCHEMBL18166298 0.91 P2RX3 (0.42) P2RX3P2RX2
SCHEMBL18166359 0.90 P2RX3 (0.40) P2RX3P2RX2
SCHEMBL18166305 0.88 P2RX3 (0.53) P2RX3P2RX2
SCHEMBL18166303 0.88 ROCK1 (0.39) P2RX3P2RX2
SCHEMBL10243170 0.88 P2RX3 (0.65) P2RX3P2RX2
SCHEMBL18166286 0.87 ROCK1 (0.40) P2RX3P2RX2
SCHEMBL18166312 0.87 KMT2A (0.40) P2RX3P2RX2
SCHEMBL18166463 0.86 P2RX3 (0.49) P2RX3P2RX2
SCHEMBL18166380 0.84 P2RX3 (0.48) P2RX3P2RX2
SCHEMBL18166349 0.84 P2RX3 (0.48) P2RX3P2RX2

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-2038264-B1 TETRAZOLE-SUBSTITUTED ARYLAMIDES HOFFMANN LA ROCHE (CH) 2016-10-26 EP claimed