SCHEMBL9820462

SCHEMBL9820462

CCCCCCCCCCCCCCOc1ccc(C(C)=CC(=O)O)cc1

nearest known ligand 0.68

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.68
TSHR P16473 1/20 0.68
PLA2G4B P0C869 6/20 0.66
RARB P10826 3/20 0.62
PLA2G4A P47712 2/20 0.59
GAA P10253 1/20 0.57
THRA P10827 2/20 0.56
THRB P10828 2/20 0.56
L3MBTL1 Q9Y468 1/20 0.54
NR5A1 Q13285 1/20 0.53

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
SCHEMBL10338197 1.00 TP53 (0.68) TP53TSHRPLA2G4BRARBPLA2G4A
SCHEMBL7609890 0.87 L3MBTL1 (0.56) TP53TSHRPLA2G4BRARBPLA2G4A
SCHEMBL15991117 0.85 L3MBTL1 (0.53) TP53TSHRPLA2G4BRARBGAA
SCHEMBL15991852 0.84 L3MBTL1 (0.51) TP53TSHRPLA2G4BRARBPLA2G4A
SCHEMBL7032077 0.83 TP53 (0.63) TP53TSHRPLA2G4BRARBPLA2G4A
SCHEMBL12016648 0.83 TP53 (0.63) TP53TSHRPLA2G4BRARBPLA2G4A
SCHEMBL17805676 0.82 TP53 (0.68) TP53TSHRPLA2G4BRARBPLA2G4A
SCHEMBL762326 0.81 GAA (0.86) TP53TSHRPLA2G4BRARBPLA2G4A
SCHEMBL2039972 0.81 GAA (0.86) TP53TSHRPLA2G4BRARBPLA2G4A
SCHEMBL10497781 0.81 GAA (0.86) TP53TSHRPLA2G4BRARBPLA2G4A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0240184-B1 ALPHA-METHYLCINNAMIC ACID ESTER DERIVATIVE AND LIQUID CRYSTAL COMPOSITION MITSUBISHI RAYON CO., LTD. (JP) 1991-08-21 EP disclosed