SCHEMBL7837233

SCHEMBL7837233

CCCCC(CO)(CCCC)NS(=O)(=O)c1ccc(N(C)C)cc1Cc1ccc(OC)cc1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
CNR2 P34972 1/20 0.35
APP P05067 2/20 0.34
ACHE P22303 1/20 0.34
SMN1; SMN2 Q16637 4/20 0.33
LMNA P02545 3/20 0.33
HTT P42858 3/20 0.33
ALDH1A1 P00352 2/20 0.33
TSHR P16473 2/20 0.33
GAA P10253 2/20 0.33
MAPT P10636 2/20 0.33
CALM1 P0DP23 2/20 0.33
MAPK1 P28482 1/20 0.33
GFER P55789 1/20 0.33
BMP1 P13497 2/20 0.33
MAOA P21397 1/20 0.33
MAOB P27338 1/20 0.33
MMP9 P14780 1/20 0.33
MMP13 P45452 1/20 0.33

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
SCHEMBL7846693 0.88 LIMK1 (0.33) MEN1KMT2ACNR2SMN1; SMN2LMNA
SCHEMBL7845578 0.86 ACHE (0.31) MEN1KMT2ACNR2ACHESMN1; SMN2
SCHEMBL7846237 0.86 APP (0.34) MEN1KMT2ACNR2APPSMN1; SMN2
SCHEMBL7846110 0.82 CNR2 (0.37) MEN1KMT2ACNR2APPLMNA
SCHEMBL7846878 0.81 CYP1A2 (0.36) MEN1KMT2ASMN1; SMN2LMNAHTT
SCHEMBL7846525 0.78 CNR2 (0.40) MEN1KMT2ACNR2ACHELMNA
SCHEMBL7846493 0.76 ALDH1A1 (0.38) MEN1KMT2ACNR2APPSMN1; SMN2
SCHEMBL6200975 0.76 CNR2 (0.33) MEN1KMT2ACNR2APPALDH1A1
SCHEMBL7837755 0.76 CNR2 (0.35) MEN1KMT2ACNR2APPCALM1
SCHEMBL7837216 0.74 CNR1 (0.34) CNR2SMN1; SMN2LMNAHTTALDH1A1

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