SCHEMBL17787222

SCHEMBL17787222

COCc1nn(Cc2ccc(Cn3cccn3)cc2)cc1C(=O)NCc1cc(OC)c2c(N)nccc2c1

nearest known ligand 0.65

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ KLKB1 P03952 20/20 0.65

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
SCHEMBL17787157 0.89 KLKB1 (0.78) KLKB1
SCHEMBL17787202 0.88 KLKB1 (0.66) KLKB1
SCHEMBL17786914 0.86 KLKB1 (0.72) KLKB1
SCHEMBL17787047 0.85 KLKB1 (0.51) KLKB1
SCHEMBL17786997 0.83 KLKB1 (0.64) KLKB1
SCHEMBL17787095 0.83 KLKB1 (0.59) KLKB1
SCHEMBL17787062 0.82 KLKB1 (0.53) KLKB1
SCHEMBL17787055 0.82 KLKB1 (0.52) KLKB1
SCHEMBL17787053 0.82 KLKB1 (0.76) KLKB1
SCHEMBL17786841 0.81 KLKB1 (0.72) KLKB1

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
WO-2016083816-A1 N-((HETEROARYLMETHYL)-HETEROARYL-CARBOXAMIDE DERIVATIVES AS PLASMA KALLIKREIN INHIBITORS KALVISTA PHARMACEUTICALS LIMITED (GB) 2016-06-02 — — WO claimed
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