SCHEMBL1432359

SCHEMBL1432359

Cc1nc(N)ccc1CNC(=O)[C@@H](CNC(=O)[C@H](N)Cc1ccc(Cl)cc1)c1ccc(Cl)c(Cl)c1

nearest known ligand 0.48

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ F2 P00734 15/20 0.48
▸ PRSS1 P07477 3/20 0.41
▸ KLKB1 P03952 2/20 0.38

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
SCHEMBL1431740 0.93 F2 (0.46) F2
SCHEMBL1432354 0.88 HDAC8 (0.45) F2PRSS1KLKB1
SCHEMBL3154741 0.85 F2 (0.58) F2KLKB1
SCHEMBL3149590 0.85 F2 (0.58) F2KLKB1
SCHEMBL1432496 0.84 F2 (0.44) F2PRSS1
SCHEMBL1431488 0.84 MALT1 (0.39) —
SCHEMBL1431804 0.83 F2 (0.43) F2PRSS1KLKB1
SCHEMBL1432357 0.82 F2 (0.53) F2PRSS1
SCHEMBL3148675 0.82 F2 (0.53) F2PRSS1
SCHEMBL1431704 0.78 MASP2 (0.43) 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
EP-2300428-A1 AMINOPYRIDINE DERIVATIVES Vantia Limited (GB) 2011-03-30 — — EP disclosed
WO-2009133348-A1 AMINOPYRIDINE DERIVATIVES VANTIA LIMITED (GB) 2009-11-05 — — WO disclosed
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