SCHEMBL2171618

SCHEMBL2171618

Cc1ccc(S(=O)(=O)Nc2cccc(N(C)C3CCNCC3)c2)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 1/20 0.50
CDK1 P06493 1/20 0.50
CCNB1 P14635 1/20 0.50
CCNA2 P20248 1/20 0.50
CDK2 P24941 1/20 0.50
CDK7 P50613 1/20 0.50
CCNH P51946 1/20 0.50
CCNA1 P78396 1/20 0.50
FFAR4 Q5NUL3 1/20 0.50
ALDH1A1 P00352 6/20 0.47
CA12 O43570 1/20 0.47
CA1 P00915 1/20 0.47
CA2 P00918 1/20 0.47
CA9 Q16790 1/20 0.47
LMNA P02545 9/20 0.46
SMN1; SMN2 Q16637 4/20 0.46
MAPT P10636 3/20 0.46
HTT P42858 2/20 0.46
XBP1 P17861 1/20 0.46
MAPK1 P28482 1/20 0.46

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
SCHEMBL2169949 0.91 ALDH1A1 (0.58) ALDH1A1LMNASMN1; SMN2HTTLIMK2
SCHEMBL2169818 0.90 HSD17B2 (0.49) FFAR1FFAR4ALDH1A1LMNASMN1; SMN2
SCHEMBL2170713 0.90 L3MBTL1 (0.49) FFAR1CDK1CCNB1CCNA2CDK2
SCHEMBL2171076 0.88 SLC2A1 (0.46) ALDH1A1LMNASMN1; SMN2MAPTHTT
SCHEMBL2169824 0.80 ESR1 (0.45) FFAR1CDK1CCNB1CCNA2CDK2
SCHEMBL2170768 0.80 ESR1 (0.45) FFAR4ALDH1A1LMNASMN1; SMN2MAPT
SCHEMBL2169880 0.80 HTR6 (0.41) ALDH1A1LMNAMAPTHTTLIMK2
SCHEMBL2550898 0.77 DDB1 (0.36)
SCHEMBL16827668 0.76 NR3C1 (0.45) ALDH1A1SMN1; SMN2
SCHEMBL9480276 0.75 CA12 (0.65) FFAR1CDK1CCNB1CCNA2CDK2

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-2346847-A1 ARYL SULFONAMIDE AMINE COMPOUNDS AND THEIR USE AS 5-HT6 LIGANDS Suven Life Sciences Limited (IN) 2011-07-27 EP disclosed
WO-2010032258-A1 ARYL SULFONAMIDE AMINE COMPOUNDS AND THEIR USE AS 5-HT6 LIGANDS SUVEN LIFE SCIENCES LIMITED (IN) 2010-03-25 WO disclosed