SCHEMBL17787202

SCHEMBL17787202

COCc1nn(Cc2ccc(Cn3cc(F)cn3)cc2)cc1C(=O)NCc1cc(OC)c2c(N)nccc2c1

nearest known ligand 0.66

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ KLKB1 P03952 20/20 0.66
▸ F11 P03951 1/20 0.48

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 0.92 KLKB1 (0.78) KLKB1
SCHEMBL17787222 0.88 KLKB1 (0.65) KLKB1
SCHEMBL17787104 0.86 KLKB1 (0.49) KLKB1
SCHEMBL17787000 0.86 KLKB1 (0.67) KLKB1
SCHEMBL17787156 0.84 KLKB1 (0.48) KLKB1
SCHEMBL17786997 0.83 KLKB1 (0.64) KLKB1F11
SCHEMBL17787095 0.83 KLKB1 (0.59) KLKB1F11
SCHEMBL17786935 0.83 KLKB1 (0.69) KLKB1
SCHEMBL17786863 0.83 KLKB1 (0.49) KLKB1
SCHEMBL17786943 0.82 KLKB1 (0.70) 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 2 patents. 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
WO-2016083816-A1 N-((HETEROARYLMETHYL)-HETEROARYL-CARBOXAMIDE DERIVATIVES AS PLASMA KALLIKREIN INHIBITORS KALVISTA PHARMACEUTICALS LIMITED (GB) 2016-06-02 — — WO disclosed
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