SCHEMBL6756540

SCHEMBL6756540

CCSN(CC)NS(=O)(=O)c1cccc2ccccc12

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HCRTR1 O43613 1/20 0.45
SCN1A P35498 2/20 0.43
SCN2A Q99250 2/20 0.43
SCN3A Q9NY46 2/20 0.43
KDM4E B2RXH2 1/20 0.43
ALDH1A1 P00352 1/20 0.43
CYP1A2 P05177 1/20 0.43
CYP3A4 P08684 1/20 0.43
CYP2C9 P11712 1/20 0.43
CYP2C19 P33261 1/20 0.43
HSD17B10 Q99714 1/20 0.43
F2 P00734 1/20 0.43
PRSS1 P07477 1/20 0.43
PRSS2 P07478 1/20 0.43
PRSS3 P35030 1/20 0.43
SLC6A9 P48067 2/20 0.42
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
CA9 Q16790 1/20 0.41
HTR6 P50406 4/20 0.41

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
SCHEMBL727637 0.76 HCRTR1 (0.54) HCRTR1SCN1ASCN2ASCN3AKDM4E
SCHEMBL2878189 0.76 SCN1A (0.59) HCRTR1SCN1ASCN2ASCN3AKDM4E
SCHEMBL3698223 0.70 HCRTR1 (0.58) HCRTR1SCN1ASCN2ASCN3AKDM4E
SCHEMBL8561210 0.70 HCRTR1 (0.51) HCRTR1SCN1ASCN2ASCN3AKDM4E
SCHEMBL3680789 0.70 CYP3A4 (0.64) HCRTR1SCN1ASCN2ASCN3AKDM4E
SCHEMBL878485 0.69 CA1 (0.61) HCRTR1SCN1ASCN2ASCN3AKDM4E
SCHEMBL6580093 0.69 CA1 (0.61) HCRTR1SCN1ASCN2ASCN3AKDM4E
SCHEMBL13979927 0.69 HTT (0.64) KDM4EALDH1A1CYP1A2CYP3A4CYP2C19
SCHEMBL28302205 0.69 HCRTR1 (0.50) HCRTR1SCN1ASCN2ASCN3AKDM4E
SCHEMBL11154008 0.69 TSHR (0.58) HCRTR1ALDH1A1HTR6TSHRPGR

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
US-6713473-B1 6-CARBAMATE-1,2,3,4-TETRAHYDROCARBAZOLE DERIVATIVES; AFFINITY FOR NEUROPEPTIDE Y RECEPTORS MEIJI SEIKA KAISHA, LTD. (JP) 2004-03-30 US disclosed
EP-1184373-A1 TRICYCLIC COMPOUNDS MEIJI SEIKA KAISHA LTD. (JP) 2002-03-06 EP disclosed