SCHEMBL7207611

SCHEMBL7207611

CC(C)c1ccc(C(=O)C(C)c2ccccc2)c(C(C)C)c1OS(N)(=O)=O

nearest known ligand 0.43

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CA1 P00915 4/20 0.37
CA2 P00918 4/20 0.37
CA9 Q16790 4/20 0.37
CA12 O43570 3/20 0.37
MEN1 O00255 1/20 0.34
CYP3A4 P08684 1/20 0.34
MAPT P10636 1/20 0.34
PPARG P37231 1/20 0.34
KMT2A Q03164 1/20 0.34

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
SCHEMBL7206852 0.90 CA12 (0.37) CA1CA2CA9CA12
SCHEMBL8497232 0.88 CA12 (0.36) CA1CA2CA9CA12
SCHEMBL7211026 0.84 CHRM2 (0.38) CA1CA2CA9CA12MEN1
SCHEMBL7211202 0.83 CA12 (0.38) CA1CA2CA9CA12
SCHEMBL7211259 0.82 CHRM3 (0.38) MEN1CYP3A4MAPTKMT2A
SCHEMBL7212811 0.82 CHRM3 (0.39) MEN1CYP3A4MAPTKMT2A
SCHEMBL7211822 0.81 STS (0.40) CA1CA2CA9CA12MAPT
SCHEMBL7207511 0.80 STS (0.48) CA1CA2CA9CA12MEN1
SCHEMBL7206838 0.80 CA1 (0.37) CA1CA2CA9CA12
SCHEMBL7207513 0.79 SOAT2 (0.38) CA1CA2CA9CA12PPARG

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 5 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
EP-0698010-B1 N-ACYL SULFAMIC ACID ESTERS (OR THIOESTERS), N-ACYL SULFONAMIDES, AND N-SULFONYL CARBAMIC ACID ESTERS (OR THIOESTERS) AS HYPERCHOLESTEROLEMIC AGENTS WARNER LAMBERT CO (US) 1999-04-14 EP disclosed
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
US-5491172-A ACYLCOENZYME A:CHOLESTEROL ACYLTRANSFERASE INHIBITORS WARNER-LAMBERT COMPANY (US) 1996-02-13 US disclosed
WO-1994026702-A1 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) 1994-11-24 WO disclosed