SCHEMBL2169880

SCHEMBL2169880

CN(c1cccc(NS(=O)(=O)c2ccccc2Br)c1)C1CCNCC1

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 5/20 0.41
BRD4 O60885 1/20 0.41
BRD2 P25440 1/20 0.41
ALDH1A1 P00352 3/20 0.40
GHSR Q92847 2/20 0.40
MAPT P10636 2/20 0.39
LMNA P02545 2/20 0.39
POLB P06746 1/20 0.37
EDNRA P25101 2/20 0.37
FABP4 P15090 1/20 0.37
FABP5 Q01469 1/20 0.37
PTPN2 P17706 1/20 0.37
PTPN1 P18031 1/20 0.37
PTPN5 P54829 1/20 0.37
MEN1 O00255 1/20 0.37
HTT P42858 1/20 0.37
KMT2A Q03164 1/20 0.37
LIMK2 P53671 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
SCHEMBL2169949 0.84 ALDH1A1 (0.58) HTR6ALDH1A1LMNAMEN1HTT
SCHEMBL2169818 0.83 HSD17B2 (0.49) HTR6ALDH1A1MAPTLMNAHTT
SCHEMBL2170956 0.82 BRD4 (0.41) HTR6BRD4BRD2MAPTPOLB
SCHEMBL2171141 0.81 HTR6 (0.49) HTR6BRD4BRD2ALDH1A1GHSR
SCHEMBL2171618 0.80 FFAR1 (0.50) HTR6ALDH1A1MAPTLMNAMEN1
SCHEMBL2170713 0.79 L3MBTL1 (0.49) HTR6BRD4ALDH1A1LMNAHTT
SCHEMBL2171076 0.77 SLC2A1 (0.46) HTR6ALDH1A1MAPTLMNAHTT
SCHEMBL2550898 0.76 DDB1 (0.36) BRD4
Hydrochloric Acid SCHEMBL5983919 0.75 F2R (0.52) ALDH1A1LMNAMEN1KMT2A
SCHEMBL16827668 0.75 NR3C1 (0.45) ALDH1A1

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 claimed
WO-2010032258-A1 ARYL SULFONAMIDE AMINE COMPOUNDS AND THEIR USE AS 5-HT6 LIGANDS SUVEN LIFE SCIENCES LIMITED (IN) 2010-03-25 WO claimed