SCHEMBL19375680

SCHEMBL19375680

CCN1c2nc(Oc3ccccc3)n(Cc3ccc(Cl)cc3)c2C(=O)N(CCCO)C1O

nearest known ligand 0.46

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ TRPC4 Q9UBN4 2/20 0.46
▸ TRPC5 Q9UL62 2/20 0.46
▸ KCNH2 Q12809 1/20 0.46
▸ TRPC1 P48995 1/20 0.42
▸ P2RX3 P56373 13/20 0.41
▸ ADORA3 P0DMS8 1/20 0.38
▸ PDE5A O76074 4/20 0.37

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
SCHEMBL19375611 0.91 TRPC4 (0.41) TRPC4TRPC5KCNH2TRPC1P2RX3
SCHEMBL19505572 0.91 TRPC4 (0.47) TRPC4TRPC5KCNH2TRPC1P2RX3
SCHEMBL20432442 0.91 TRPC5 (0.48) TRPC4TRPC5KCNH2TRPC1P2RX3
SCHEMBL19505394 0.91 TRPC5 (0.48) TRPC4TRPC5KCNH2TRPC1P2RX3
SCHEMBL19505516 0.90 TRPC5 (0.47) TRPC4TRPC5KCNH2TRPC1P2RX3
SCHEMBL19505396 0.89 TRPC4 (0.41) TRPC4TRPC5KCNH2TRPC1P2RX3
SCHEMBL19375592 0.89 TRPC5 (0.48) TRPC4TRPC5KCNH2TRPC1P2RX3
SCHEMBL19505627 0.88 TRPC5 (0.46) TRPC4TRPC5KCNH2TRPC1P2RX3
SCHEMBL19505097 0.88 TRPC5 (0.46) TRPC4TRPC5KCNH2TRPC1P2RX3
SCHEMBL21499695 0.88 TRPC5 (0.59) 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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