SCHEMBL23396385

SCHEMBL23396385

CCOc1cc(C(=O)NCc2cnc(C(F)(F)F)nc2)cc(-c2ncc(C)s2)c1

nearest known ligand 0.74

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
P2RX3 P56373 20/20 0.74
P2RX2 Q9UBL9 20/20 0.74

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
SCHEMBL23396189 0.90 P2RX3 (0.71) P2RX3P2RX2
SCHEMBL22852413 0.87 P2RX3 (0.67) P2RX3P2RX2
SCHEMBL23396285 0.87 P2RX3 (0.76) P2RX3P2RX2
SCHEMBL23396391 0.87 P2RX3 (0.74) P2RX3P2RX2
SCHEMBL23395959 0.87 P2RX3 (0.72) P2RX3P2RX2
SCHEMBL23396063 0.86 P2RX3 (0.68) P2RX3P2RX2
SCHEMBL20104555 0.86 P2RX3 (0.81) P2RX3P2RX2
SCHEMBL23396232 0.86 P2RX3 (0.61) P2RX3P2RX2
SCHEMBL23396181 0.85 P2RX3 (0.75) P2RX3P2RX2
SCHEMBL29441164 0.85 P2RX3 (1.00) 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-3230281-B1 1,3-THIAZOL-2-YL SUBSTITUTED BENZAMIDES BAYER AG (DE) 2021-05-26 EP disclosed