SCHEMBL5334580

SCHEMBL5334580

CCN1CCN(Cc2c(CS(=O)(=O)c3ccccc3)[nH]c3ccc(Br)cc23)CC1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.44
MAPT P10636 3/20 0.44
HSD17B10 Q99714 5/20 0.43
KMT2A Q03164 2/20 0.43
KDM4E B2RXH2 3/20 0.40
APOBEC3G Q9HC16 2/20 0.40
POLB P06746 2/20 0.40
MPI P34949 1/20 0.40
HTT P42858 1/20 0.40
ALOX15 P16050 1/20 0.39
PRNP P04156 1/20 0.39
CYP1A2 P05177 1/20 0.39
CYP2C9 P11712 1/20 0.39
CYP2C19 P33261 1/20 0.39
PPARG P37231 1/20 0.39
HIF1A Q16665 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
RXFP1 Q9HBX9 1/20 0.39
NR2E3 Q9Y5X4 1/20 0.39
NCOR2 Q9Y618 1/20 0.39

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
SCHEMBL5333246 0.92 POLB (0.45) ALDH1A1MAPTHSD17B10KMT2AKDM4E
SCHEMBL5332522 0.90 HSD17B10 (0.42) ALDH1A1MAPTHSD17B10KMT2AKDM4E
SCHEMBL5335240 0.88 ALDH1A1 (0.44) ALDH1A1MAPTHSD17B10KMT2AKDM4E
SCHEMBL5337329 0.88 DRD2 (0.44) ALDH1A1MAPTHSD17B10KMT2AKDM4E
SCHEMBL5333018 0.86 DDR1 (0.43) ALDH1A1HSD17B10KMT2AKDM4EPOLB
SCHEMBL5330544 0.86 HTR6 (0.43) ALDH1A1HSD17B10KMT2AKDM4EALOX15
SCHEMBL5336272 0.83 HSD17B10 (0.45) ALDH1A1MAPTHSD17B10KMT2AKDM4E
SCHEMBL5331983 0.82 HTR6 (0.52) ALDH1A1MAPTHSD17B10KMT2AKDM4E
SCHEMBL5335199 0.82 HTR6 (0.46) ALDH1A1MAPTHSD17B10KMT2AKDM4E
SCHEMBL5331060 0.81 ALDH1A1 (0.46) ALDH1A1MAPTHSD17B10KMT2AKDM4E

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2007046112-A1 ARYLTHIOETHER TRYPTAMINE DERIVATIVES AS FUNCTIONAL 5-HT6 LIGANDS SUVEN LIFE SCIENCES INC. (IN) 2007-04-26 WO disclosed