SCHEMBL7848425

SCHEMBL7848425

CCCCC(CCCC)(CO[Si](C)(C)C(C)(C)C)N(C)S(=O)(=O)c1ccc(N(C)C)cc1Cc1ccc(OC)cc1

nearest known ligand 0.33

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 3/20 0.33
KEAP1 Q14145 1/20 0.32
NFE2L2 Q16236 1/20 0.32
CNR1 P21554 3/20 0.31
APLNR P35414 1/20 0.31
NPC1 O15118 1/20 0.30
RAB9A P51151 1/20 0.30
MEN1 O00255 1/20 0.30
KMT2A Q03164 1/20 0.30

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
SCHEMBL7845257 0.89 CNR1 (0.37) CNR2KEAP1NFE2L2CNR1MEN1
SCHEMBL7846110 0.86 CNR2 (0.37) CNR2KEAP1NFE2L2CNR1MEN1
SCHEMBL7845578 0.84 ACHE (0.31) CNR2APLNRMEN1KMT2A
SCHEMBL7845845 0.84 KMT2A (0.34) CNR1MEN1KMT2A
SCHEMBL7837755 0.81 CNR2 (0.35) CNR2KEAP1NFE2L2CNR1APLNR
SCHEMBL7837399 0.78 NR1I2 (0.34) CNR2KEAP1NFE2L2
SCHEMBL7846525 0.77 CNR2 (0.40) CNR2KEAP1NFE2L2CNR1MEN1
SCHEMBL7849225 0.76 EDNRB (0.33) CNR2CNR1APLNRMEN1KMT2A
SCHEMBL6200975 0.73 CNR2 (0.33) CNR2KEAP1NFE2L2CNR1APLNR
SCHEMBL7846237 0.73 APP (0.34) CNR2CNR1MEN1KMT2A

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-1155007-A2 1,2-BENZOTHIAZEPINES FOR THE TREATMENT OF HYPERLIPIDEMIC DISEASES G.D. Searle LLC (US) 2001-11-21 EP disclosed
WO-2000047568-A2 1,2-BENZOTHIAZEPINES FOR THE TREATMENT OF HYPERLIPIDEMIC DISEASES G.D. SEARLE LLC (US) 2000-08-17 WO disclosed