SCHEMBL6756544

SCHEMBL6756544

CC(NS(=O)(=O)c1cccc2ccccc12)SCCN

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SCN1A P35498 2/20 0.50
SCN2A Q99250 2/20 0.50
SCN3A Q9NY46 2/20 0.50
CYP3A4 P08684 2/20 0.50
KDM4E B2RXH2 1/20 0.50
ALDH1A1 P00352 1/20 0.50
CYP1A2 P05177 1/20 0.50
CYP2C9 P11712 1/20 0.50
CYP2C19 P33261 1/20 0.50
HSD17B10 Q99714 1/20 0.50
SLC1A3 P43003 1/20 0.48
SLC1A2 P43004 1/20 0.48
SLC1A1 P43005 1/20 0.48
F2 P00734 2/20 0.47
PRSS1 P07477 2/20 0.47
PRSS2 P07478 2/20 0.47
PRSS3 P35030 2/20 0.47
HCRTR1 O43613 1/20 0.43
CA1 P00915 1/20 0.43
CA2 P00918 1/20 0.43

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
SCHEMBL6756547 0.80 SLC1A3 (0.58) SCN1ASCN2ASCN3ACYP3A4KDM4E
SCHEMBL6006417 0.77 SLC1A3 (0.61) SCN1ASCN2ASCN3ACYP3A4KDM4E
SCHEMBL12132457 0.77 KDM4E (0.56) SCN1ASCN2ASCN3ACYP3A4KDM4E
SCHEMBL6006410 0.75 SLC1A3 (0.55) SCN1ASCN2ASCN3ACYP3A4KDM4E
SCHEMBL20025843 0.75 SLC1A3 (0.55) SCN1ASCN2ASCN3ACYP3A4KDM4E
SCHEMBL13951132 0.74 SLC1A3 (0.54) SCN1ASCN2ASCN3ACYP3A4KDM4E
SCHEMBL6756542 0.73 CYP3A4 (0.67) SCN1ASCN2ASCN3ACYP3A4KDM4E
SCHEMBL6006634 0.72 CYP3A4 (0.69) SCN1ASCN2ASCN3ACYP3A4KDM4E
SCHEMBL4263470 0.71 CYP3A4 (0.78) SCN1ASCN2ASCN3ACYP3A4KDM4E
SCHEMBL9468163 0.71 SLC1A3 (0.64) SCN1ASCN2ASCN3ACYP3A4KDM4E

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