SCHEMBL3877246

SCHEMBL3877246

CC(C)N1CCC(N(CC(=O)Nc2ccc(Cl)cn2)S(=O)(=O)CCNC(=O)Oc2ccc(Cl)s2)CC1

nearest known ligand 0.43

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
F10 P00742 9/20 0.43
F2 P00734 1/20 0.43
USP30 Q70CQ3 1/20 0.36
POLB P06746 1/20 0.35
DEGS1 O15121 1/20 0.35
L3MBTL1 Q9Y468 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
SCHEMBL220506 0.88 F10 (0.55) F10F2USP30POLBDEGS1
SCHEMBL3878974 0.82 F10 (0.49) F10F2USP30POLBDEGS1
SCHEMBL4592967 0.82 F10 (0.42) F10F2USP30POLBDEGS1
SCHEMBL3875763 0.81 F10 (0.47) F10F2
SCHEMBL3874943 0.81 F10 (0.43) F10F2
SCHEMBL3879157 0.80 F10 (0.46) F10F2
SCHEMBL3876204 0.79 F10 (0.42) F10F2
SCHEMBL4592966 0.79 F10 (0.42) F10F2USP30POLBDEGS1
SCHEMBL3878969 0.79 F10 (0.49) F10F2USP30POLBDEGS1
SCHEMBL3875017 0.78 F10 (0.49) F10F2

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-1888567-B1 HETEROARYL-CARBOXYLIC ACID (SULFAMOYL ALKYL) AMIDE - DERIVATIVES AS FACTOR XA INHIBITORS SANOFI AVENTIS (FR) 2009-12-16 EP claimed