SCHEMBL7206959

SCHEMBL7206959

CC(C)c1[c]c(C(C)C)cc(C(=O)COc2c(C(C)C)cccc2C(C)C)c1

nearest known ligand 0.43

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
GLRA1 P23415 1/20 0.39
SRD5A2 P31213 1/20 0.39
SCN5A Q14524 1/20 0.38
SCN9A Q15858 1/20 0.38
SCN10A Q9Y5Y9 1/20 0.38
SOAT2 O75908 1/20 0.35
MYC P01106 1/20 0.35
SOAT1 P35610 1/20 0.35
MAP2K3 P46734 1/20 0.35

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
SCHEMBL7206870 0.86 SRD5A2 (0.39) GLRA1SRD5A2SOAT2MYCSOAT1
SCHEMBL7206347 0.78 GABRA1 (0.43) SCN5ASCN9ASCN10ASOAT2MYC
SCHEMBL7206954 0.77 SRD5A2 (0.34) GLRA1SRD5A2SCN5ASCN9ASCN10A
SCHEMBL9474040 0.74 KMT2A (0.55) GLRA1SRD5A2
SCHEMBL9474053 0.72 SCN5A (0.41) GLRA1SCN5ASCN9ASCN10A
SCHEMBL15517637 0.71 NLRP3 (0.46)
SCHEMBL15517271 0.69 OGG1 (0.48)
SCHEMBL9472848 0.69 NLRP3 (0.61) SCN5ASCN9ASCN10A
SCHEMBL7212859 0.69 AKR1B1 (0.45)
SCHEMBL7206379 0.68 LMNA (0.42)

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-0841913-B1 USE OF SULFAMIC ACID DERIVATIVES, ACYL SULFONAMIDES OR SULFONYL CARBAMATES FOR THE MANUFACTURE OF A MEDICAMENT FOR LOWERING LIPOPROTEIN LEVELS WARNER LAMBERT CO (US) 2003-02-05 EP claimed
US-5633287-A N-acyl sulfamic acid esters (or thioesters), N-acyl sulfonamides, and n-sulfonyl carbamic acid esters (or thioesters) as hypercholesterolemic agents WARNER-LAMBERT COMPANY (US) 1997-05-27 US disclosed