SCHEMBL8893793

SCHEMBL8893793

Cc1c(C)c2c(c(C)c1OCc1ccccc1)CCC(C)(COc1ccc(CC3SC(=O)NC3=O)c3ccccc13)O2

nearest known ligand 0.39

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.39
MAPT P10636 2/20 0.39
KMT2A Q03164 2/20 0.39
TDP1 Q9NUW8 2/20 0.39
FFAR1 O14842 6/20 0.35
PPARG P37231 3/20 0.35
ALDH1A1 P00352 1/20 0.35
TP53 P04637 1/20 0.35
CYP1A2 P05177 1/20 0.35
CYP3A4 P08684 1/20 0.35
HPGD P15428 1/20 0.35
ALOX15 P16050 1/20 0.35
TSHR P16473 1/20 0.35
HSD17B10 Q99714 1/20 0.35
PSEN1 P49768 5/20 0.34
CA2 P00918 1/20 0.33
PPARA Q07869 2/20 0.33
PTPN1 P18031 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
SCHEMBL8893199 0.79 MAPT (0.40) MEN1MAPTKMT2ATDP1PPARG
SCHEMBL8893417 0.79 KMT2A (0.49) MEN1KMT2ATDP1ALDH1A1HPGD
SCHEMBL8893422 0.79 KMT2A (0.49) MEN1KMT2ATDP1ALDH1A1HPGD
SCHEMBL3804957 0.79 MAPT (0.49) MEN1MAPTKMT2ATDP1PPARG
SCHEMBL8715367 0.77 FFAR1 (0.51) MAPTFFAR1PPARGCA2PPARA
SCHEMBL6977206 0.77 PPARG (0.46) MEN1MAPTKMT2ATDP1FFAR1
SCHEMBL6968604 0.76 PPARG (0.46) MEN1MAPTKMT2ATDP1FFAR1
SCHEMBL10641731 0.76 PPARG (0.49) MEN1MAPTKMT2ATDP1FFAR1
SCHEMBL9631327 0.75 MEN1 (0.54) MEN1MAPTKMT2ATDP1FFAR1
SCHEMBL6963536 0.75 PPARG (0.46) MEN1MAPTKMT2ATDP1FFAR1

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-1997043284-A1 NEW THIAZOLIDINEDIONES, PROCESS FOR PREPARING THE SAME AND MEDICAMENTS CONTAINING THE SAME BOEHRINGER MANNHEIM GMBH (DE) 1997-11-20 WO disclosed