SCHEMBL2169949

SCHEMBL2169949

CN(c1cccc(NS(=O)(=O)c2ccccc2)c1)C1CCNCC1

nearest known ligand 0.58

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.58
HTR6 P50406 8/20 0.52
LIMK2 P53671 1/20 0.47
GAA P10253 2/20 0.46
HPGD P15428 1/20 0.46
LMNA P02545 3/20 0.45
IL1RN P18510 1/20 0.44
KEAP1 Q14145 1/20 0.44
ERAP1 Q9NZ08 1/20 0.44
HTR2C P28335 1/20 0.43
HTR2B P41595 1/20 0.43
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
HTT P42858 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42

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 0.91 FFAR1 (0.50) ALDH1A1HTR6LIMK2GAALMNA
SCHEMBL2170713 0.90 L3MBTL1 (0.49) ALDH1A1HTR6LIMK2LMNAL3MBTL1
SCHEMBL2169818 0.90 HSD17B2 (0.49) ALDH1A1HTR6LIMK2GAALMNA
SCHEMBL2171076 0.88 SLC2A1 (0.46) ALDH1A1HTR6LIMK2LMNAHTT
SCHEMBL2169880 0.84 HTR6 (0.41) ALDH1A1HTR6LIMK2LMNAMEN1
SCHEMBL2170403 0.81 HTR6 (0.50) ALDH1A1HTR6LIMK2GAAHPGD
SCHEMBL2170726 0.81 HTR6 (0.49) ALDH1A1HTR6LIMK2GAAHPGD
SCHEMBL2170067 0.81 CCNT1 (0.50) ALDH1A1HTR6LIMK2GAAHPGD
Hydrochloric Acid SCHEMBL2169494 0.80 CCNT1 (0.49) ALDH1A1HTR6LIMK2GAAHPGD
SCHEMBL2550898 0.79 DDB1 (0.36) HTR2C

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