SCHEMBL18834366

SCHEMBL18834366

CC(C)c1ccccc1Oc1nc2c(n1Cc1ccc(Cl)cc1)C(=O)N(CCCO)C(O)N2C

nearest known ligand 0.38

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ TRPC5 Q9UL62 3/20 0.38
▸ TRPC4 Q9UBN4 2/20 0.38
▸ KCNH2 Q12809 1/20 0.38
▸ P2RX3 P56373 16/20 0.36
▸ TRPC1 P48995 1/20 0.36
▸ TBXA2R P21731 1/20 0.33
▸ PTGDR Q13258 1/20 0.33

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
SCHEMBL18834254 0.90 TRPC4 (0.40) TRPC5TRPC4KCNH2P2RX3TRPC1
SCHEMBL19505503 0.88 TRPC4 (0.39) TRPC5TRPC4KCNH2P2RX3TRPC1
SCHEMBL18834945 0.88 TRPC4 (0.39) TRPC5TRPC4KCNH2P2RX3TRPC1
SCHEMBL19505572 0.86 TRPC4 (0.47) TRPC5TRPC4KCNH2P2RX3TRPC1
SCHEMBL18834916 0.85 TRPC4 (0.45) TRPC5TRPC4KCNH2P2RX3TRPC1
SCHEMBL21499643 0.84 P2RX3 (0.45) TRPC5TRPC4KCNH2P2RX3
SCHEMBL18833918 0.84 P2RX3 (0.35) TRPC5TRPC4KCNH2P2RX3TRPC1
SCHEMBL19374881 0.83 P2RX3 (0.44) TRPC5TRPC4KCNH2P2RX3
SCHEMBL21499648 0.83 TRPC4 (0.40) TRPC5TRPC4KCNH2P2RX3TRPC1
SCHEMBL20432022 0.83 TRPC4 (0.42) TRPC5TRPC4KCNH2P2RX3TRPC1

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