SCHEMBL6868635

SCHEMBL6868635

Cc1cnc(NC2CCC(NS(=O)(=O)c3ccccc3)CC2)nc1N(C)C

nearest known ligand 0.55

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 11/20 0.55
ADRA2A P08913 7/20 0.55
HTR2B P41595 6/20 0.55
HRH1 P35367 5/20 0.55
ADRA1A P35348 4/20 0.54
HTR1A P08908 2/20 0.47
NPY5R Q15761 1/20 0.43
HTR7 P34969 1/20 0.41
CDK7 P50613 1/20 0.41
CDK9 P50750 1/20 0.41
STK4 Q13043 1/20 0.41
BRD4 O60885 1/20 0.41
CSNK2A2 P19784 1/20 0.40
CSNK2B P67870 1/20 0.40
CSNK2A1 P68400 1/20 0.40
SYK P43405 1/20 0.40
JAK2 O60674 1/20 0.39
JAK1 P23458 1/20 0.39
TYK2 P29597 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
SCHEMBL6868629 1.00 MCHR1 (0.55) MCHR1ADRA2AHTR2BHRH1ADRA1A
SCHEMBL6458818 0.89 MCHR1 (0.65) MCHR1ADRA2AHTR2BHRH1ADRA1A
SCHEMBL6458824 0.89 MCHR1 (0.65) MCHR1ADRA2AHTR2BHRH1ADRA1A
Hydrochloric Acid SCHEMBL6459831 0.88 MCHR1 (0.64) MCHR1ADRA2AHTR2BHRH1ADRA1A
Hydrochloric Acid SCHEMBL6459836 0.88 MCHR1 (0.64) MCHR1ADRA2AHTR2BHRH1ADRA1A
Hydrochloric Acid SCHEMBL6459371 0.84 MCHR1 (0.51) MCHR1ADRA2AHTR2BHRH1ADRA1A
Hydrochloric Acid SCHEMBL6459376 0.84 MCHR1 (0.51) MCHR1ADRA2AHTR2BHRH1ADRA1A
Hydrochloric Acid SCHEMBL6456621 0.83 MCHR1 (0.52) MCHR1ADRA2AHTR2BHRH1ADRA1A
Hydrochloric Acid SCHEMBL6456628 0.83 MCHR1 (0.52) MCHR1ADRA2AHTR2BHRH1ADRA1A
Hydrochloric Acid SCHEMBL6457366 0.82 MCHR1 (0.49) MCHR1ADRA2AHTR2BHRH1ADRA1A

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
EP-1464335-A2 Quinoline, tetrahydroquinoline and pyrimidine derivatives as mch antagonist Taisho Pharmaceutical Co. Ltd. (JP) 2004-10-06 EP disclosed