SCHEMBL9634846

SCHEMBL9634846

O=C(O)c1ccc(OC(CCCOc2ccccc2)C(=O)O)cc1

nearest known ligand 0.64

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PPARG P37231 8/20 0.64
PPARA Q07869 7/20 0.64
PKM P14618 1/20 0.64
FOLH1 Q04609 1/20 0.56
MAPK1 P28482 1/20 0.54
PARP10 Q53GL7 1/20 0.53
RARB P10826 1/20 0.51
TP53 P04637 1/20 0.50
TSHR P16473 1/20 0.50
PTGES O14684 1/20 0.50
ALOX5 P09917 1/20 0.50
PLA2G4B P0C869 2/20 0.49
ALDH1A1 P00352 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
NR4A1 P22736 1/20 0.49
NR4A2 P43354 1/20 0.49
NR4A3 Q92570 1/20 0.49
PPARD Q03181 1/20 0.48

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
SCHEMBL11345159 0.91 PPARG (0.70) PPARGPPARAFOLH1PARP10PTGES
SCHEMBL9613979 0.82 PPARG (0.63) PPARGPPARAFOLH1PTGESALOX5
SCHEMBL9069705 0.81 PKM (0.66) PPARGPPARAPKMMAPK1PARP10
SCHEMBL9623613 0.81 FOLH1 (0.51) PPARGPPARAPKMFOLH1MAPK1
SCHEMBL9622883 0.81 FOLH1 (0.51) PPARGPPARAPKMFOLH1MAPK1
SCHEMBL5054619 0.81 FOLH1 (0.72) PPARGPPARAFOLH1MAPK1RARB
SCHEMBL2233261 0.81 TP53 (0.54) PPARGPPARAFOLH1RARBTP53
SCHEMBL6320665 0.81 GAA (0.56) PPARGPPARAPKMMAPK1PARP10
SCHEMBL10623741 0.81 PPARA (0.51) PPARGPPARAPKMMAPK1PARP10
SCHEMBL9614177 0.81 PPARG (0.61) PPARGPPARAFOLH1PTGESALOX5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-3221521-A None JP disclosed
US-5162484-A THERMOTROPIC SEMIALIPHATIC COPOLYESTERAMIDES ATOCHEM (FR) 1992-11-10 US disclosed
US-5138021-A High melting, anisotropic, excellent mechanical properties ATOCHEM (FR) 1992-08-11 US disclosed
JP-H03221521-A WHOLLY AROMATIC POLYESTER, FILM AND MOLDED PRODUCT THEREOF TOYOBO CO LTD 1991-09-30 JP disclosed
EP-0305070-A1 A melt-processable copolyester MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 1989-03-01 EP disclosed
EP-0099933-B1 PROCESS FOR PREPARING ALPHA,OMEGA-BIS(2-CHLOROPHENOXY)-ALKANE-4,4'-DICARBOXYLIC ACID OR ITS LOWER ALKYL ESTER TORAY INDUSTRIES, INC. (JP) 1986-04-02 EP disclosed
US-4531009-A Chlorination of bis(phenoxy)alkane-4,4'-dicarboxylic acid or ester TORAY INDUSTRIES, INC. (JP) 1985-07-23 US disclosed
EP-0099933-A1 PROCESS FOR PREPARING ALPHA,OMEGA-BIS(2-CHLOROPHENOXY)-ALKANE-4,4'-DICARBOXYLIC ACID OR ITS LOWER ALKYL ESTER TORAY INDUSTRIES, INC. (JP) 1984-02-08 EP disclosed