SCHEMBL4592966

SCHEMBL4592966

CC(C)N1CCC(N(CC(=O)Nc2ccc(Cl)cn2)S(=O)(=O)CC(N)=O)CC1.O=C(O)c1ccc(Cl)s1

nearest known ligand 0.42

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
F10 P00742 8/20 0.42
F2 P00734 1/20 0.42
USP30 Q70CQ3 1/20 0.37
POLB P06746 1/20 0.37
HTT P42858 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
DEGS1 O15121 1/20 0.35

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
SCHEMBL4592967 0.91 F10 (0.42) F10F2USP30POLBHTT
SCHEMBL3878969 0.91 F10 (0.49) F10F2USP30POLBHTT
SCHEMBL220506 0.84 F10 (0.55) F10F2USP30POLBDEGS1
SCHEMBL3878974 0.81 F10 (0.49) F10F2USP30POLBHTT
SCHEMBL3877246 0.79 F10 (0.43) F10F2USP30POLBDEGS1
SCHEMBL3872358 0.69 MAPK1 (0.32) NPSR1
SCHEMBL3875568 0.68 F10 (0.53) F10F2
SCHEMBL219872 0.66 F10 (0.63) F10SMN1; SMN2
SCHEMBL219860 0.65 F10 (0.65) F10SMN1; SMN2
SCHEMBL3877037 0.65

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-1888567-A1 HETEROARYL-CARBOXYLIC ACID (SULFAMOYL ALKYL) AMIDE - DERIVATIVES AS FACTOR XA INHIBITORS Sanofi-Aventis (FR) 2008-02-20 EP disclosed
WO-2006122661-A1 HETEROARYL-CARBOXYLIC ACID (SULFAMOYL ALKYL) AMIDE - DERIVATIVES AS FACTOR XA INHIBITORS SANOFI-AVENTIS (DE) 2006-11-23 WO disclosed