SCHEMBL9633124

SCHEMBL9633124

C=C(c1ccccc1)c1cccc(C(C)C(=O)OC)c1

nearest known ligand 0.74

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGS1 P23219 6/20 0.74
PTGS2 P35354 5/20 0.74
MAPT P10636 4/20 0.51
ALDH1A1 P00352 3/20 0.51
CXCR1 P25024 2/20 0.51
CXCR2 P25025 2/20 0.51
SMN1; SMN2 Q16637 2/20 0.51
LMNA P02545 2/20 0.51
CYP3A4 P08684 2/20 0.51
RECQL P46063 1/20 0.51
KDM4E B2RXH2 1/20 0.51
HPGD P15428 1/20 0.51
MAPK1 P28482 1/20 0.51
PMP22 Q01453 1/20 0.51
SLC22A6 Q4U2R8 1/20 0.51
HSD17B10 Q99714 1/20 0.51
CXCL8 P10145 1/20 0.51
THPO P40225 1/20 0.51
HIF1A Q16665 1/20 0.51
KMT2A Q03164 3/20 0.47

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
SCHEMBL9633406 0.87 PTGS2 (0.56) PTGS1PTGS2MAPTALDH1A1CXCR1
SCHEMBL9632527 0.86 PTGS2 (0.55) PTGS1PTGS2MAPTALDH1A1CXCR1
SCHEMBL13176839 0.85 PTGS1 (0.52) PTGS1PTGS2MAPTALDH1A1CXCR1
SCHEMBL577323 0.85 PTGS1 (1.00) PTGS1PTGS2MAPTALDH1A1CXCR1
SCHEMBL8754918 0.85 PTGS1 (1.00) PTGS1PTGS2MAPTALDH1A1CXCR1
SCHEMBL12935378 0.85 PTGS1 (1.00) PTGS1PTGS2MAPTALDH1A1CXCR1
SCHEMBL9086931 0.85 PTGS1 (1.00) PTGS1PTGS2MAPTALDH1A1CXCR1
SCHEMBL9633442 0.85 PTGS1 (0.53) PTGS1PTGS2MAPTALDH1A1CXCR1
SCHEMBL9634034 0.85 PTGS2 (0.57) PTGS1PTGS2MAPTALDH1A1CXCR1
SCHEMBL31455828 0.84 PTGS1 (0.77) PTGS1PTGS2MAPTALDH1A1CXCR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0304495-B1 PROCESS FOR SELECTIVELY MONOHYDROESTERIFYING DIOLEFIN NIPPON PETROCHEMICALS COMPANY, LIMITED (JP) 1992-05-27 EP disclosed
EP-0282065-B1 (PHENYLETHENYL) PHENYLPROPIONIC ACID AND ITS ESTER, AND METHOD FOR PRODUCING (BENZOYLPHENYL) PROPIONIC ACID OR ITS ESTER NIPPON PETROCHEMICALS COMPANY, LIMITED (JP) 1992-05-27 EP disclosed
EP-0282063-B1 1-(3-VINYLPHENYL)-1-PHENYL-HYDROCARBONS AND METHOD FOR PRODUCING THE SAME NIPPON PETROCHEMICALS COMPANY, LIMITED (JP) 1991-10-16 EP disclosed
US-4937375-A (Phenylethenyl)phenylpropionic acid and its ester, and method for producing (benzoylphenyl)propionic acid or its ester NIPPON PETROCHEMICALS COMPANY, LIMITED (JP) 1990-06-26 US disclosed
US-4908473-A Reacting a (1-arylethenyl)vinylbenzene with carbon monoxide and water or alcohol in the presence of carbonylation catalyst NIPPON PETROCHEMICALS COMPANY, LIMITED (JP) 1990-03-13 US disclosed
US-4822934-A CHEMICAL INTERMEDIATES; KETOPROFEN NIPPON PETROCHEMICALS COMPANY, LIMITED (JP) 1989-04-18 US disclosed
EP-0304495-A1 PROCESS FOR SELECTIVELY MONOHYDROESTERIFYING DIOLEFIN NIPPON PETROCHEMICALS COMPANY, LIMITED (JP) 1989-03-01 EP disclosed
EP-0282065-A2 (Phenylethenyl) phenylpropionic acid and its ester, and method for producing (benzoylphenyl) propionic acid or its ester NIPPON PETROCHEMICALS COMPANY, LIMITED (JP) 1988-09-14 EP disclosed
EP-0282063-A1 1-(3-Vinylphenyl)-1-phenyl-hydrocarbons and method for producing the same NIPPON PETROCHEMICALS COMPANY, LIMITED (JP) 1988-09-14 EP disclosed