SCHEMBL4593144

SCHEMBL4593144

NCC(C1CCN(c2ccncc2)C(C(N)=O)C1)S(=O)(=O)O

nearest known ligand 0.31

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
LSS P48449 2/20 0.31
ITGB3 P05106 4/20 0.31
ITGA2B P08514 4/20 0.31
CHRM1 P11229 4/20 0.31
SYK P43405 1/20 0.30

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
SCHEMBL4700677 0.73 SYK (0.39) LSSITGB3ITGA2BSYK
SCHEMBL6513376 0.69 PIM1 (0.43) SYK
SCHEMBL1674952 0.64 MAPT (0.33) LSSITGB3ITGA2BSYK
SCHEMBL3166116 0.63 CHKA (0.42) ITGB3ITGA2B
SCHEMBL7029894 0.62 SYK (0.44) SYK
SCHEMBL6706219 0.61 PORCN (0.44)
SCHEMBL6706218 0.61 PORCN (0.44)
SCHEMBL8631656 0.60 ITGB3 (0.38) ITGB3ITGA2B
SCHEMBL7918841 0.60 SMN1; SMN2 (0.50) ITGB3ITGA2B
SCHEMBL6703929 0.60 SMN1; SMN2 (0.50) ITGB3ITGA2B

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