SCHEMBL19375568

SCHEMBL19375568

CN1c2nc(Oc3ccc(Cl)c(F)c3)n(Cc3ccc(Cl)cc3)c2C(=O)N(CCCO)C1O

nearest known ligand 0.43

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ TRPC4 Q9UBN4 2/20 0.43
▸ TRPC5 Q9UL62 2/20 0.43
▸ KCNH2 Q12809 1/20 0.43
▸ TRPC1 P48995 1/20 0.42
▸ P2RX3 P56373 16/20 0.38
▸ TSHR P16473 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
SCHEMBL18834279 0.93 ADORA3 (0.39) TRPC4TRPC5KCNH2TRPC1P2RX3
SCHEMBL18834916 0.91 TRPC4 (0.45) TRPC4TRPC5KCNH2TRPC1P2RX3
SCHEMBL20432022 0.90 TRPC4 (0.42) TRPC4TRPC5KCNH2TRPC1P2RX3
SCHEMBL22619613 0.87 TRPC5 (0.57) TRPC4TRPC5KCNH2TRPC1P2RX3
SCHEMBL21316297 0.87 TRPC4 (0.42) TRPC4TRPC5KCNH2TRPC1P2RX3
SCHEMBL19505500 0.87 TRPC5 (0.50) TRPC4TRPC5KCNH2TRPC1P2RX3
SCHEMBL19505572 0.86 TRPC4 (0.47) TRPC4TRPC5KCNH2TRPC1P2RX3
SCHEMBL19505249 0.86 TRPC5 (0.49) TRPC4TRPC5KCNH2TRPC1P2RX3
SCHEMBL19374704 0.86 TRPC4 (0.42) TRPC4TRPC5KCNH2TRPC1P2RX3
SCHEMBL21499683 0.85 P2RX3 (0.51) TRPC4TRPC5KCNH2TRPC1P2RX3

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-B9 SUBSTITUTED XANTHINES AND METHODS OF USE THEREOF HYDRA BIOSCIENCES INC (US) 2017-09-20 — — EP disclosed
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