SCHEMBL8962537

SCHEMBL8962537

CC(C)c1cccc(C(C)C)c1NS(=O)(=O)C(S)C(=O)O

nearest known ligand 0.52

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.46
KMT2A Q03164 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.43
NLRP3 Q96P20 1/20 0.42

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
SCHEMBL8962429 0.81
SCHEMBL9391001 0.79 LMNA (0.44) LMNAKMT2ASMN1; SMN2
SCHEMBL8962989 0.79 KMT2A (0.48) LMNAKMT2A
SCHEMBL8962467 0.78 MAPK1 (0.43) NLRP3
SCHEMBL8962780 0.76
SCHEMBL8962444 0.75 SOAT2 (0.41) LMNAKMT2A
SCHEMBL7082105 0.74 NLRP3 (0.50) LMNAKMT2ANLRP3
SCHEMBL8962380 0.73 LMNA (0.47) LMNAKMT2ASMN1; SMN2
SCHEMBL8962531 0.73 SMN1; SMN2 (0.47) LMNAKMT2ASMN1; SMN2
SCHEMBL11234113 0.72 L3MBTL1 (0.63) LMNAKMT2ASMN1; SMN2NLRP3

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-1996019446-A1 β-CARBOXY SULFONAMIDE ACAT INHIBITORS WARNER-LAMBERT COMPANY (US) 1996-06-27 WO claimed
WO-1996019446-A1 β-CARBOXY SULFONAMIDE ACAT INHIBITORS WARNER-LAMBERT COMPANY (US) 1996-06-27 WO disclosed
US-5491170-A TREATMENT OF HYPERCHOLESTEROLEMIA AND ATHEROSCLEROSIS WARNER-LAMBERT COMPANY (US) 1996-02-13 US disclosed