SCHEMBL2170713

SCHEMBL2170713

CN(c1cccc(NS(=O)(=O)c2ccc(F)cc2)c1)C1CCNCC1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.49
ALDH1A1 P00352 3/20 0.46
LMNA P02545 3/20 0.45
CACNA1H O95180 1/20 0.44
CACNA1B Q00975 1/20 0.44
ESR1 P03372 2/20 0.44
LIMK2 P53671 2/20 0.43
HTT P42858 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
BRD4 O60885 1/20 0.43
ALOX12 P18054 1/20 0.42
HTR6 P50406 1/20 0.41
TSHR P16473 1/20 0.41
FFAR1 O14842 1/20 0.41
CDK1 P06493 1/20 0.41
CCNB1 P14635 1/20 0.41
CCNA2 P20248 1/20 0.41
CDK2 P24941 1/20 0.41
CDK7 P50613 1/20 0.41
CCNH P51946 1/20 0.41

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
SCHEMBL2171618 0.90 FFAR1 (0.50) L3MBTL1ALDH1A1LMNAESR1LIMK2
SCHEMBL2169949 0.90 ALDH1A1 (0.58) L3MBTL1ALDH1A1LMNALIMK2HTT
SCHEMBL2169818 0.89 HSD17B2 (0.49) ALDH1A1LMNAESR1LIMK2HTT
SCHEMBL2171076 0.87 SLC2A1 (0.46) ALDH1A1LMNALIMK2HTTSMN1; SMN2
SCHEMBL2170714 0.81 LMNA (0.45) ALDH1A1LMNAESR1HTTSMN1; SMN2
SCHEMBL2170564 0.81 HSD17B3 (0.48) L3MBTL1ALDH1A1LMNAESR1HTT
SCHEMBL2169880 0.79 HTR6 (0.41) ALDH1A1LMNALIMK2HTTBRD4
SCHEMBL2171351 0.79 LMNA (0.52) ALDH1A1LMNAESR1HTTSMN1; SMN2
Hydrochloric Acid SCHEMBL5982835 0.77 MEN1 (0.53) ALDH1A1ESR1HTT
SCHEMBL2550898 0.76 DDB1 (0.36) BRD4

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