SCHEMBL2303191

SCHEMBL2303191

CN1CCC([AsH]c2cc(NS(=O)(=O)c3ccc(F)cc3)ccc2F)CC1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 4/20 0.50
DRD2 P14416 2/20 0.50
HTR2A P28223 2/20 0.50
HTR2C P28335 2/20 0.50
DRD3 P35462 2/20 0.50
SMN1; SMN2 Q16637 3/20 0.48
TP53 P04637 2/20 0.48
PKM P14618 1/20 0.48
CYP1A2 P05177 1/20 0.47
CYP3A4 P08684 1/20 0.47
CYP2D6 P10635 1/20 0.47
CYP2C9 P11712 1/20 0.47
CYP2C19 P33261 1/20 0.47
LMNA P02545 3/20 0.46
KMT2A Q03164 2/20 0.46
KDM4E B2RXH2 1/20 0.46
POLB P06746 1/20 0.45
MAPT P10636 2/20 0.44
HSD17B10 Q99714 1/20 0.44
ALDH1A1 P00352 2/20 0.44

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
SCHEMBL2170217 0.81 SMN1; SMN2 (0.49) HTR6DRD2HTR2AHTR2CDRD3
SCHEMBL2205372 0.77 GHSR (0.52) HTR6DRD2HTR2AHTR2CDRD3
SCHEMBL2170110 0.74 L3MBTL1 (0.52) HTR6HTR2AHTR2CDRD3SMN1; SMN2
SCHEMBL6117477 0.74 TP53 (0.47) HTR6SMN1; SMN2TP53PKMCYP3A4
SCHEMBL5871087 0.73 HTR1A (0.64) HTR6DRD2HTR2AHTR2CDRD3
SCHEMBL2169741 0.73 HSD17B3 (0.49) HTR6DRD2HTR2AHTR2CDRD3
SCHEMBL4873695 0.73 ALDH1A1 (0.58) HTR2AHTR2CSMN1; SMN2TP53PKM
SCHEMBL2170321 0.72 CYP3A4 (0.59) HTR6DRD2HTR2AHTR2CDRD3
SCHEMBL7574073 0.71 CA1 (0.62) SMN1; SMN2TP53PKMCYP3A4CYP2C9
SCHEMBL5212060 0.71 HTR1F (0.68) SMN1; SMN2CYP1A2CYP3A4CYP2D6CYP2C9

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