SCHEMBL6288699

SCHEMBL6288699

CC/C(=C(/C(=O)O)C(=O)Cl)c1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CES2 O00748 2/20 0.46
CES1 P23141 2/20 0.46
ESR1 P03372 7/20 0.44
ESR2 Q92731 4/20 0.44
CYP19A1 P11511 2/20 0.44
PGR P06401 2/20 0.43
PTGS2 P35354 3/20 0.42
TRPA1 O75762 1/20 0.39
ALDH1A1 P00352 1/20 0.39
MAPK1 P28482 1/20 0.39
GSK3B P49841 1/20 0.39
HIF1A Q16665 1/20 0.39
MAPT P10636 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39

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
SCHEMBL8515211 0.88 CES1 (0.52) CES2CES1ESR1ESR2CYP19A1
SCHEMBL5746996 0.81 CES2 (0.48) CES2CES1ESR1ESR2CYP19A1
SCHEMBL9232542 0.77 CES1 (0.44) CES2CES1ESR1ESR2CYP19A1
SCHEMBL9447847 0.76 CES1 (0.52) CES2CES1ESR1ESR2CYP19A1
SCHEMBL8624493 0.76 ESR1 (0.60) CES2CES1ESR1ESR2CYP19A1
SCHEMBL3314631 0.75 ESR1 (0.61) CES2CES1ESR1ESR2CYP19A1
SCHEMBL8596721 0.75 ESR1 (0.61) CES2CES1ESR1ESR2CYP19A1
SCHEMBL4613506 0.75 CES2 (0.50) CES2CES1ESR1ESR2CYP19A1
SCHEMBL1982010 0.75 CES2 (0.50) CES2CES1ESR1ESR2CYP19A1
SCHEMBL5279624 0.75 CES2 (0.50) CES2CES1ESR1ESR2CYP19A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6858269-B2 Photo-alignment materials for liquid crystal alignment film SAMSUNG ELECTRONICS CO., LTD. (KR) 2005-02-22 US disclosed
US-20030118752-A1 Photo-alignment materials for liquid crystal alignment film SAMSUNG ELECTRONICS CO., LTD. 2003-06-26 US disclosed
US-6569972-B1 Photo-alignment materials for liquid crystal alignment film SAMSUNG ELECTRONICS CO., LTD. (KR) 2003-05-27 US disclosed
EP-1281726-A1 Photo-alignment materials for liquid crystal alignment film SAMSUNG ELECTRONICS CO LTD. (KR) 2003-02-05 EP disclosed
EP-1281746-A2 Photo-alignment materials for liquid crystal alignment film SAMSUNG ELECTRONICS CO., LTD. (KR) 2003-02-05 EP disclosed