SCHEMBL30091981

SCHEMBL30091981

Cc1cnc(-c2cc(OCC3(F)CCCN(C(=O)OC(C)(C)C)C3)cc(C(=O)O)c2)s1

nearest known ligand 0.55

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
P2RX3 P56373 20/20 0.55
P2RX2 Q9UBL9 20/20 0.55

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
SCHEMBL17823825 1.00 P2RX3 (0.55) P2RX3P2RX2
SCHEMBL19950705 0.92 P2RX3 (0.54) P2RX3P2RX2
SCHEMBL30277271 0.92 P2RX3 (0.54) P2RX3P2RX2
SCHEMBL19950623 0.89 P2RX3 (0.51) P2RX3P2RX2
SCHEMBL17824232 0.84 P2RX3 (0.81) P2RX3P2RX2
SCHEMBL28480279 0.84 P2RX3 (0.81) P2RX3P2RX2
SCHEMBL17823576 0.83 P2RX3 (0.54) P2RX3P2RX2
SCHEMBL30091947 0.81 P2RX3 (0.55) P2RX3P2RX2
SCHEMBL17824049 0.81 P2RX3 (0.55) P2RX3P2RX2
SCHEMBL19950319 0.81 P2RX3 (0.65) 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
CN-110256418-B 1, 3-thiazol-2-yl substituted benzamides 拜耳公司 2023-01-20 CN disclosed