SCHEMBL4592502

SCHEMBL4592502

CC(C)N1CCC(CNS(=O)(=O)CCN2C(=O)c3ccccc3C2=O)CC1

nearest known ligand 0.50

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MAOB P27338 4/20 0.50
ACHE P22303 2/20 0.47
PARG Q86W56 1/20 0.39
HTR4 Q13639 2/20 0.39
ALDH1A1 P00352 2/20 0.39
MAPT P10636 1/20 0.39
BRD4 O60885 1/20 0.38
RORC P51449 1/20 0.38
PKM P14618 1/20 0.38
ENPP1 P22413 1/20 0.37
APLNR P35414 1/20 0.36

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
SCHEMBL222333 0.84 MAOB (0.52) MAOBACHEALDH1A1
SCHEMBL4592504 0.76 MAOB (0.49) MAOBACHEALDH1A1MAPT
SCHEMBL219546 0.76 MAOB (0.51) MAOBACHE
SCHEMBL3885138 0.73 HTR4 (0.33) HTR4ALDH1A1PKMENPP1
SCHEMBL4592501 0.73 MAOB (0.48) MAOBACHEALDH1A1MAPTPKM
Taltrimide SCHEMBL29866257 0.72 NPSR1 (0.48) MAOBALDH1A1
Taltrimide SCHEMBL347001 0.72 NPSR1 (0.48) MAOBALDH1A1
SCHEMBL221260 0.71 MAOB (0.46) MAOBACHE
SCHEMBL3757316 0.70 GLS (0.49)
SCHEMBL18605556 0.70 GLS (0.42) MAOBACHE

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