SCHEMBL9632803

SCHEMBL9632803

CCN1C(=O)SC(Cc2ccc(OCC3(C)CCc4c(C)c(O)c(C)c(C)c4O3)cc2)C1=O

nearest known ligand 0.57

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.57
MEN1 O00255 2/20 0.57
KMT2A Q03164 2/20 0.57
TDP1 Q9NUW8 2/20 0.57
PPARG P37231 6/20 0.47
ALOX5 P09917 1/20 0.39
CYP1A2 P05177 2/20 0.37
CYP3A4 P08684 2/20 0.37
TSHR P16473 2/20 0.37
ALDH1A1 P00352 1/20 0.37
TP53 P04637 1/20 0.37
HPGD P15428 1/20 0.37
ALOX15 P16050 1/20 0.37
HSD17B10 Q99714 1/20 0.37
PTGS1 P23219 1/20 0.37
PTGS2 P35354 1/20 0.37
MCL1 Q07820 1/20 0.36
CYP4F2 P78329 1/20 0.36

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
SCHEMBL9632239 0.91 MEN1 (0.55) MAPTMEN1KMT2ATDP1PPARG
SCHEMBL10281136 0.90 MAPT (0.59) MAPTMEN1KMT2ATDP1PPARG
SCHEMBL9630803 0.89 MEN1 (0.52) MAPTMEN1KMT2ATDP1PPARG
SCHEMBL11925102 0.88 MAPT (0.57) MAPTMEN1KMT2ATDP1PPARG
SCHEMBL19849369 0.88 MAPT (0.43) MAPTMEN1KMT2ATDP1PPARG
SCHEMBL4100211 0.87 MAPT (0.56) MAPTMEN1KMT2ATDP1PPARG
Troglitazone SCHEMBL15888838 0.84 MEN1 (0.64) MAPTMEN1KMT2ATDP1PPARG
Troglitazone SCHEMBL1536757 0.84 MEN1 (0.64) MAPTMEN1KMT2ATDP1PPARG
Troglitazone SCHEMBL5672813 0.84 MEN1 (0.64) MAPTMEN1KMT2ATDP1PPARG
Troglitazone SCHEMBL21630 0.84 MEN1 (0.64) MAPTMEN1KMT2ATDP1PPARG

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
US-5104888-A Anticholesterol or antidiabetic agents SANKYO COMPANY, LIMITED (JP) 1992-04-14 US disclosed
EP-0207581-B1 THIAZOLIDINE DERIVATIVES, THEIR PREPARATION AND USE SANKYO COMPANY LIMITED (JP) 1990-09-12 EP disclosed
EP-0207581-A2 Thiazolidine derivatives, their preparation and use SANKYO COMPANY LIMITED (JP) 1987-01-07 EP disclosed