SCHEMBL1903269

SCHEMBL1903269

CCC(=O)NC(CC1CCCC2CCCCC21)C(=O)NCc1ccc(N)nc1

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ MASP2 O00187 3/20 0.40
▸ PSMB10 P40306 3/20 0.39
▸ PSMB2 P49721 3/20 0.39
▸ FURIN P09958 1/20 0.38
▸ CPB2 Q96IY4 4/20 0.36
▸ PSMB5 P28074 1/20 0.36
▸ TLR2 O60603 1/20 0.35
▸ ITGB3 P05106 1/20 0.35
▸ ITGA2B P08514 1/20 0.35
▸ CPB1 P15086 1/20 0.35
▸ F2 P00734 1/20 0.35
▸ PRSS1 P07477 1/20 0.35
▸ PPIB P23284 1/20 0.34
▸ F10 P00742 1/20 0.34

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
SCHEMBL1903263 1.00 MASP2 (0.40) MASP2PSMB10PSMB2FURINCPB2
SCHEMBL1431917 0.92 PSMB10 (0.40) MASP2PSMB10PSMB2FURINCPB2
SCHEMBL1431923 0.92 PSMB10 (0.40) MASP2PSMB10PSMB2FURINCPB2
SCHEMBL1432775 0.91 PSMB10 (0.39) MASP2PSMB10PSMB2FURINCPB2
SCHEMBL1907760 0.91 PSMB10 (0.41) MASP2PSMB10PSMB2FURINCPB2
SCHEMBL3141239 0.91 PSMB10 (0.39) MASP2PSMB10PSMB2FURINCPB2
SCHEMBL1907759 0.91 PSMB10 (0.41) MASP2PSMB10PSMB2FURINCPB2
SCHEMBL1905957 0.91 PSMB10 (0.39) MASP2PSMB10PSMB2FURINCPB2
SCHEMBL1907930 0.89 MASP2 (0.41) MASP2PSMB10PSMB2FURINCPB2
SCHEMBL1432232 0.89 MASP2 (0.43) MASP2PSMB10PSMB2FURINCPB2

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-2011051671-A1 AMINOPYRIDINE DERIVATIVES AS KALLIKREIN INHIBITORS VANTIA LIMITED (GB) 2011-05-05 — — WO disclosed
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