SCHEMBL18834891

SCHEMBL18834891

CC/C=C1/c2c(nc(Oc3cccc(OC(F)(F)F)c3)n2Cc2ccc(Cl)cc2)N(Cc2ccccc2)C(=O)N1C

nearest known ligand 0.48

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ TRPC5 Q9UL62 5/20 0.48
▸ TRPC4 Q9UBN4 2/20 0.48
▸ TRPC1 P48995 1/20 0.48
▸ CHRM5 P08912 3/20 0.40
▸ P2RX3 P56373 6/20 0.40
▸ KCNH2 Q12809 1/20 0.36
▸ PPARG P37231 3/20 0.36
▸ PPARA Q07869 3/20 0.36
▸ KCNN4 O15554 2/20 0.35
▸ BRD4 O60885 1/20 0.35
▸ CYP1A2 P05177 1/20 0.35
▸ CYP2D6 P10635 1/20 0.35
▸ CYP2C9 P11712 1/20 0.35
▸ CYP2C19 P33261 1/20 0.35
▸ CYP4X1 Q8N118 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
SCHEMBL16364030 0.79 TRPC5 (0.47) TRPC5TRPC4TRPC1CHRM5P2RX3
SCHEMBL18834234 0.78 TRPC5 (0.43) TRPC5TRPC4TRPC1CHRM5P2RX3
SCHEMBL20432257 0.77 TRPC5 (0.50) TRPC5TRPC4TRPC1CHRM5P2RX3
SCHEMBL18833767 0.77 TRPC5 (0.51) TRPC5TRPC4TRPC1CHRM5P2RX3
SCHEMBL18834618 0.76 TRPC5 (0.54) TRPC5TRPC4TRPC1CHRM5P2RX3
SCHEMBL19505209 0.76 TRPC5 (0.52) TRPC5TRPC4TRPC1CHRM5P2RX3
SCHEMBL30642043 0.75 TRPC5 (0.53) TRPC5TRPC4TRPC1CHRM5P2RX3
SCHEMBL21332654 0.74 TRPC5 (0.52) TRPC5TRPC4TRPC1CHRM5P2RX3
SCHEMBL21316291 0.74 TRPC5 (0.54) TRPC5TRPC4TRPC1CHRM5P2RX3
SCHEMBL16364000 0.74 TRPC5 (0.48) TRPC5TRPC4TRPC1CHRM5P2RX3

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-2970303-B1 SUBSTITUTED XANTHINES AND METHODS OF USE THEREOF HYDRA BIOSCIENCES INC (US) 2017-05-10 — — EP disclosed
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