SCHEMBL18166274

SCHEMBL18166274

Cc1ccc(-c2cc(OC(=O)NCc3cnc(C)cn3)cc(-n3nnnc3C(C)C)c2)c(F)c1

nearest known ligand 0.49

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
P2RX3 P56373 13/20 0.49
P2RX2 Q9UBL9 13/20 0.49
FAAH O00519 1/20 0.35

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
SCHEMBL18166390 0.95 P2RX3 (0.50) P2RX3P2RX2FAAH
SCHEMBL18166287 0.93 P2RX3 (0.47) P2RX3P2RX2FAAH
SCHEMBL18166281 0.92 P2RX3 (0.41) P2RX3P2RX2FAAH
SCHEMBL18166289 0.91 P2RX3 (0.39) P2RX3P2RX2
SCHEMBL18166446 0.89 P2RX3 (0.45) P2RX3P2RX2
SCHEMBL18166357 0.88 P2RX3 (0.46) P2RX3P2RX2FAAH
SCHEMBL18166367 0.88 MAOB (0.40) P2RX3P2RX2FAAH
SCHEMBL10244488 0.88 P2RX3 (0.63) P2RX3P2RX2
SCHEMBL18166455 0.85 FAAH (0.42) FAAH
SCHEMBL18166452 0.84 P2RX3 (0.39) 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