SCHEMBL23769259

SCHEMBL23769259

Cc1c(Cn2cc(C(=O)O)cn2)cnc(N2CC3CC3C2)c1C

nearest known ligand 0.50

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
KLKB1 P03952 10/20 0.50
BTK Q06187 9/20 0.42
L3MBTL1 Q9Y468 1/20 0.41

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
SCHEMBL23843196 0.88 KLKB1 (0.64) KLKB1BTKL3MBTL1
SCHEMBL18816719 0.81 BTK (0.59) KLKB1BTKL3MBTL1
SCHEMBL22166243 0.81 KLKB1 (0.59) KLKB1BTKL3MBTL1
SCHEMBL23769640 0.81 KLKB1 (0.44) KLKB1BTKL3MBTL1
SCHEMBL23754057 0.79 KLKB1 (0.43) KLKB1BTKL3MBTL1
SCHEMBL23769633 0.78 KLKB1 (0.46) KLKB1BTKL3MBTL1
SCHEMBL30140684 0.77 KLKB1 (0.61) KLKB1BTK
SCHEMBL20541004 0.77 KLKB1 (0.61) KLKB1BTK
SCHEMBL23769232 0.77 BTK (0.47) KLKB1BTKL3MBTL1
SCHEMBL23843100 0.77 KLKB1 (0.44) KLKB1BTKL3MBTL1

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-2021160718-A1 HETEROAROMATIC CARBOXAMIDE DERIVATIVES AS PLASMA KALLIKREIN INHIBITORS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2021-08-19 WO disclosed