SCHEMBL9328640

SCHEMBL9328640

CCC(=O)OC(C)c1ccc(-c2ccc(C(=O)O)cc2)cc1

nearest known ligand 0.46

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
GRIA4 P48058 1/20 0.46
RXRA P19793 5/20 0.46
RXRB P28702 5/20 0.46
RXRG P48443 1/20 0.45
RARB P10826 8/20 0.44
SRD5A2 P31213 1/20 0.44
HTT P42858 1/20 0.43
HSD17B10 Q99714 1/20 0.42
BCL2 P10415 1/20 0.42

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
SCHEMBL9330542 0.84 RARB (0.51) RARB
SCHEMBL9547851 0.84 ESR1 (0.40)
SCHEMBL9329597 0.83 RXRA (0.43) RXRARXRBRARB
SCHEMBL9329291 0.82 HSD17B10 (0.54) GRIA4RXRARXRBRXRGRARB
SCHEMBL9329707 0.82 MAPT (0.47) GRIA4RXRARXRBRXRGRARB
SCHEMBL9329701 0.82 MAPT (0.47) GRIA4RXRARXRBRXRGRARB
SCHEMBL10476920 0.81 ALOX5 (0.49)
SCHEMBL25527471 0.81 ANPEP (0.49) GRIA4RXRARXRBRXRGRARB
SCHEMBL9231000 0.80 HCAR2 (0.54) HSD17B10
SCHEMBL538486 0.80 HCAR2 (0.54) HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5332675-A Liquid crystals SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1994-07-26 US disclosed
EP-0289307-B1 OPTICALLY ACTIVE AROMATIC CARBOXYLIC ACID DERIVATIVES AND PROCESS FOR PRODUCING THE SAME SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1992-07-08 EP disclosed
US-5019298-A Optically active aromatic carboxylic acid derivatives and process for producing the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1991-05-28 US disclosed
EP-0289307-A2 Optically active aromatic carboxylic acid derivatives and process for producing the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1988-11-02 EP disclosed