SCHEMBL8474246

SCHEMBL8474246

Cc1c(C)c2c(c(C)c1O)CCC(C)(COc1ccc(C3SC(=O)N(C)C3=O)cc1)O2

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.56
MEN1 O00255 2/20 0.56
KMT2A Q03164 2/20 0.56
TDP1 Q9NUW8 1/20 0.56
PPARG P37231 1/20 0.46
CYP4F2 P78329 1/20 0.40
LMNA P02545 2/20 0.38
USP2 O75604 2/20 0.38
CYP2C9 P11712 2/20 0.38
GSTP1 P09211 1/20 0.38
TTPA P49638 1/20 0.38
THRB P10828 1/20 0.38
CYP2C19 P33261 1/20 0.38
ALOX5 P09917 3/20 0.37
NR1I2 O75469 2/20 0.37
CYP3A4 P08684 2/20 0.37
TSHR P16473 2/20 0.37
PTGS1 P23219 1/20 0.37
PTGS2 P35354 1/20 0.37
CYP1A2 P05177 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
SCHEMBL10281136 0.86 MAPT (0.59) MAPTMEN1KMT2ATDP1PPARG
SCHEMBL8470929 0.84 MAPT (0.42) MAPTMEN1KMT2ATDP1PPARG
SCHEMBL8473756 0.84 MAPT (0.42) MAPTMEN1KMT2ATDP1PPARG
Hydrochloric Acid SCHEMBL8472181 0.84 MAPT (0.41) MAPTMEN1KMT2ATDP1PPARG
Maleic Acid SCHEMBL8472381 0.81 MAPT (0.39) MAPTMEN1KMT2ATDP1PPARG
SCHEMBL8003203 0.80 MAPT (0.64) MAPTMEN1KMT2ATDP1PPARG
SCHEMBL9632803 0.78 MAPT (0.57) MAPTMEN1KMT2ATDP1PPARG
Troglitazone SCHEMBL5672808 0.78 MEN1 (0.64) MAPTMEN1KMT2ATDP1PPARG
Troglitazone SCHEMBL15888838 0.78 MEN1 (0.64) MAPTMEN1KMT2ATDP1PPARG
Troglitazone SCHEMBL1536757 0.78 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5708012-A Use of thiazolidinedione derivatives and related antihyperglycemic agents in the treatment of insulin resistant subjects with normal glucose tolerance in order to prevent or delay the onset of noninsulin-dependent mellitus SANKYO COMPANY, LIMITED (JP) 1998-01-13 US claimed
US-5952356-A TREATING DIABETES IN A MAMMAL WITH AN ACTIVE MATERIAL AND A GLUCOSIDASE INHIBITOR TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1999-09-14 US disclosed
US-5874454-A Use of thiazolidinedione derivatives in the treatment of polycystic ovary syndrome, gestational diabetes and disease states at risk for progressing to noninsulin-dependent diabetes mellitus WARNER-LAMBERT COMPANY (US) 1999-02-23 US disclosed
US-5708012-A Use of thiazolidinedione derivatives and related antihyperglycemic agents in the treatment of insulin resistant subjects with normal glucose tolerance in order to prevent or delay the onset of noninsulin-dependent mellitus SANKYO COMPANY, LIMITED (JP) 1998-01-13 US disclosed