SCHEMBL9059802

SCHEMBL9059802

CC(C)c1cccc(C(C)C)c1NS(=O)(=O)c1[c]cccc1

nearest known ligand 0.46

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.42
LMNA P02545 1/20 0.40
KMT2A Q03164 1/20 0.40
POLB P06746 1/20 0.40
NLRP3 Q96P20 2/20 0.39
NPC1 O15118 1/20 0.38
SLC40A1 Q9NP59 1/20 0.37

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
SCHEMBL11410337 0.75 NPSR1 (0.43) LMNAPOLB
SCHEMBL9059808 0.74 NLRP3 (0.47) L3MBTL1LMNAKMT2APOLBNLRP3
SCHEMBL7051356 0.73 KEAP1 (0.53) KMT2APOLB
SCHEMBL16796919 0.72 ADAMTS4 (0.34) L3MBTL1LMNAKMT2APOLB
SCHEMBL157674 0.72 L3MBTL1 (0.40) L3MBTL1LMNANPC1
SCHEMBL11234113 0.72 L3MBTL1 (0.63) L3MBTL1LMNAKMT2APOLBNLRP3
SCHEMBL8558659 0.71 ALDH1A1 (0.45) KMT2A
SCHEMBL11427391 0.71 ALDH1A1 (0.51) L3MBTL1KMT2APOLB
SCHEMBL482661 0.71 CA1 (0.53) LMNAKMT2A
SCHEMBL4879238 0.71 L3MBTL1 (0.47) L3MBTL1LMNAKMT2APOLBNLRP3

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 1 patent. 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 disclosed