SCHEMBL29835913

SCHEMBL29835913

COCc1nn(Cc2ccc(Cn3ccccc3=O)cc2)cc1C(=O)NCc1cc(OC)ccc1C(F)F

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ KLKB1 P03952 20/20 1.00

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
SCHEMBL17785379 1.00 KLKB1 (1.00) KLKB1
SCHEMBL17785358 0.91 KLKB1 (1.00) KLKB1
SCHEMBL31339406 0.91 KLKB1 (1.00) KLKB1
SCHEMBL21145570 0.90 KLKB1 (0.82) KLKB1
SCHEMBL31339403 0.90 KLKB1 (1.00) KLKB1
SCHEMBL17785309 0.90 KLKB1 (1.00) KLKB1
SCHEMBL21145542 0.89 KLKB1 (1.00) KLKB1
SCHEMBL17785428 0.89 KLKB1 (0.85) KLKB1
SCHEMBL17785332 0.88 KLKB1 (1.00) KLKB1
SCHEMBL17785409 0.88 KLKB1 (1.00) 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
EP-4039681-A1 N-((HET)ARYLMETHYL)-HETEROARYL-CARBOXAMIDES COMPOUNDS AS PLASMA KALLIKREIN INHIBITORS Kalvista Pharmaceuticals Limited (GB) 2022-08-10 — — EP disclosed
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