SCHEMBL9487296

SCHEMBL9487296

CC(CCC(CCOc1ccc(C(=O)O)cc1)C(=O)O)Oc1ccccc1

nearest known ligand 0.58

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.58
PKM P14618 1/20 0.56
RARB P10826 1/20 0.49
PPARG P37231 1/20 0.48
PPARA Q07869 1/20 0.48
KMT2A Q03164 1/20 0.47
PLA2G4B P0C869 7/20 0.46
TP53 P04637 1/20 0.45
TSHR P16473 1/20 0.45
MAPT P10636 1/20 0.45
RAB9A P51151 1/20 0.45
NR1H4 Q96RI1 1/20 0.44
NR4A1 P22736 1/20 0.43
NR4A2 P43354 1/20 0.43
NR4A3 Q92570 1/20 0.43
PARP10 Q53GL7 1/20 0.43
PLA2G4A P47712 1/20 0.43
PTGER4 P35408 1/20 0.43
PTGER2 P43116 1/20 0.43

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
SCHEMBL5400573 0.88 MAPK1 (0.73) MAPK1PKMRARBKMT2APLA2G4B
SCHEMBL8432243 0.88 MAPK1 (0.73) MAPK1PKMRARBKMT2APLA2G4B
SCHEMBL9487027 0.85 PKM (0.54) MAPK1PKMRARBPPARGPPARA
SCHEMBL9069705 0.84 PKM (0.66) MAPK1PKMRARBPPARGPPARA
SCHEMBL9319143 0.81 KMT2A (0.69) MAPK1PKMRARBKMT2APLA2G4B
SCHEMBL7613153 0.80 RARB (0.69) MAPK1PKMRARBKMT2APLA2G4B
SCHEMBL7363754 0.79 PPARG (0.55) MAPK1PKMPPARGPPARAMAPT
SCHEMBL1454985 0.79 KCNA3 (0.52) MAPK1PKMPPARGPPARA
SCHEMBL20528135 0.79 RARB (0.68) MAPK1PKMRARBKMT2APLA2G4B
SCHEMBL13556990 0.77 MAPK1 (0.73) MAPK1PKMRARBKMT2APLA2G4B

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-0305070-B1 A MELT-PROCESSABLE COPOLYESTER MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 1993-03-03 EP disclosed
US-5045627-A From bis(phenoxy)alkane dicarboxylic acids, liquid crystalline, heat resistant, nonhydrolyzing, molding materials MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 1991-09-03 US disclosed
EP-0305070-A1 A melt-processable copolyester MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 1989-03-01 EP disclosed