SCHEMBL9328518

SCHEMBL9328518

CCCOC(C)c1ccc(-c2ccc(C(=O)O)cc2)cc1

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
RARB P10826 11/20 0.50
GRIA4 P48058 1/20 0.46
RXRA P19793 3/20 0.45
RXRB P28702 3/20 0.45
RXRG P48443 1/20 0.45
MEN1 O00255 1/20 0.45
ALDH1A1 P00352 1/20 0.45
RARA P10276 1/20 0.45
MAPT P10636 1/20 0.45
MTOR P42345 1/20 0.45
KMT2A Q03164 1/20 0.45
CASR P41180 1/20 0.45
SRD5A2 P31213 1/20 0.44
PTPN11 Q06124 1/20 0.44
MAPK1 P28482 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
SCHEMBL1749896 0.95 TP53 (0.46) RARBRXRARXRBALDH1A1MAPT
SCHEMBL9329247 0.90 RARB (0.65) RARBMEN1ALDH1A1RARAMAPT
SCHEMBL9330512 0.90 RARB (0.65) RARBMEN1ALDH1A1RARAMAPT
SCHEMBL9328575 0.90 RARB (0.65) RARBMEN1ALDH1A1RARAMAPT
SCHEMBL9331239 0.90 RARB (0.65) RARBMEN1ALDH1A1RARAMAPT
SCHEMBL9257016 0.87 TP53 (0.57) RARBRXRARXRBKMT2AMAPK1
SCHEMBL9329267 0.85 RARB (0.50) RARBGRIA4RXRARXRBRXRG
SCHEMBL8162563 0.84 TP53 (0.62) RARBPTPN11
SCHEMBL9329632 0.84 TP53 (0.62) RARBPTPN11
SCHEMBL9329676 0.84 TP53 (0.62) RARBPTPN11

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-1199934-A None JP disclosed
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
JP-H01199934-A OPTICALLY ACTIVE SUBSTITUTED BIPHENYLCARBOXYLIC ACIDS AND PRODUCTION THEREOF SUMITOMO CHEM CO LTD 1989-08-11 JP 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