SCHEMBL4657479

SCHEMBL4657479

CCOC(=O)C1=C(c2ccccc2)c2c(C)cc(N3CCOCC3)cc2C1=O.CCOC(=O)C1=C(c2ccccc2)c2ccc(CN3CCOCC3)cc2C1(O)c1ccccc1

nearest known ligand 0.39

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PPARG P37231 6/20 0.39
ALDH1A1 P00352 6/20 0.38
LMNA P02545 4/20 0.37
DGAT1 O75907 5/20 0.35
SOAT1 P35610 4/20 0.35
NPSR1 Q6W5P4 3/20 0.35
TSHR P16473 2/20 0.35
MAPT P10636 2/20 0.35
HPGD P15428 1/20 0.35
ALOX15 P16050 1/20 0.35
HSD17B10 Q99714 1/20 0.35
PDCD1 Q15116 1/20 0.35
CD274 Q9NZQ7 1/20 0.35
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
KDM4E B2RXH2 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34

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
SCHEMBL4657478 0.88 PPARG (0.47) PPARGALDH1A1LMNADGAT1SOAT1
SCHEMBL3578413 0.86 ALDH1A1 (0.48) PPARGALDH1A1LMNADGAT1SOAT1
SCHEMBL3584460 0.82 LMNA (0.50) PPARGALDH1A1LMNADGAT1SOAT1
SCHEMBL3578416 0.79 LMNA (0.45) ALDH1A1LMNADGAT1SOAT1MAPT
SCHEMBL3565974 0.76 PPARG (0.59) PPARGALDH1A1LMNANPSR1TSHR
SCHEMBL3570960 0.73 PPARG (0.62) PPARGALDH1A1TSHRKDM4E
SCHEMBL4658819 0.72 PPARG (0.54) PPARGALDH1A1LMNANPSR1TSHR
Hydrochloric Acid SCHEMBL3574111 0.72 PPARG (0.61) PPARGALDH1A1TSHRKDM4E
SCHEMBL13316128 0.67 PPARG (0.74) PPARG
SCHEMBL4658548 0.67 PPARG (0.76) PPARG

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
EP-1756036-A4 INDENE DERIVATIVES AND PROCESS FOR THE PREPARATION THEREOF KOREA RES INST CHEM TECH (KR) 2008-04-16 EP disclosed
EP-1756036-A1 INDENE DERIVATIVES AND PROCESS FOR THE PREPARATION THEREOF Korea Research Institute of Chemical Technology (KR) 2007-02-28 EP disclosed
WO-2005100297-A1 INDENE DERIVATIVES AND PROCESS FOR THE PREPARATION THEREOF KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 2005-10-27 WO disclosed