SCHEMBL6966486

SCHEMBL6966486

COc1cc(C=CCO)ccc1OCc1nc(-c2ccco2)oc1C

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARG P37231 1/20 0.53
KDM4E B2RXH2 8/20 0.47
ALDH1A1 P00352 7/20 0.47
MAPT P10636 6/20 0.47
SMN1; SMN2 Q16637 5/20 0.47
HSD17B10 Q99714 4/20 0.47
HPGD P15428 3/20 0.47
TSHR P16473 3/20 0.47
LMNA P02545 2/20 0.43
ALOX15 P16050 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
ADORA2A P29274 1/20 0.40
MAPK1 P28482 2/20 0.40
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
PTGS1 P23219 1/20 0.40
TP53 P04637 1/20 0.40
NFKB1 P19838 1/20 0.40
NFKB2 Q00653 1/20 0.40

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
SCHEMBL8340592 1.00 PPARG (0.53) PPARGKDM4EALDH1A1MAPTSMN1; SMN2
SCHEMBL6160140 0.87 PPARG (0.57) PPARGKDM4EALDH1A1MAPTSMN1; SMN2
SCHEMBL6584922 0.86 PPARG (0.55) PPARGKDM4EALDH1A1MAPTSMN1; SMN2
SCHEMBL8335514 0.86 PPARG (0.55) PPARGKDM4EALDH1A1MAPTSMN1; SMN2
SCHEMBL6961189 0.86 FDPS (0.53) PPARGKDM4EALDH1A1MAPTSMN1; SMN2
SCHEMBL6961196 0.86 FDPS (0.53) PPARGKDM4EALDH1A1MAPTSMN1; SMN2
SCHEMBL6583683 0.84 FDPS (0.57) PPARGKDM4EALDH1A1MAPTSMN1; SMN2
SCHEMBL6584580 0.84 FDPS (0.57) PPARGKDM4EALDH1A1MAPTSMN1; SMN2
SCHEMBL4035637 0.84 PPARG (0.62) PPARGKDM4EALDH1A1MAPTSMN1; SMN2
SCHEMBL4848084 0.83 PPARG (0.53) PPARGKDM4EALDH1A1MAPTSMN1; SMN2

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0783496-B9 THIAZOLIDINEDIONE DERIVATIVES, THEIR PRODUCTION AND USE TAKEDA CHEMICAL INDUSTRIES LTD (JP) 2003-09-03 EP disclosed
EP-0783496-B1 THIAZOLIDINEDIONE DERIVATIVES, THEIR PRODUCTION AND USE TAKEDA CHEMICAL INDUSTRIES LTD (JP) 2003-03-26 EP disclosed
US-5965589-A AN ACTIVE MATERIAL HAVING HYPOGLYCEMIC ACTIVITY AND BLOOD LIPID LOWERING ACTIVITY, FOR USE AS AN ANTIDIABETIC AGENT TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1999-10-12 US disclosed
EP-0783496-A1 THIAZOLIDINEDIONE DERIVATIVES, THEIR PRODUCTION AND USE Takeda Chemical Industries, Ltd. (JP) 1997-07-16 EP disclosed
WO-1996005186-A1 THIAZOLIDINEDIONE DERIVATIVES, THEIR PRODUCTION AND USE TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1996-02-22 WO disclosed