SCHEMBL9329265

SCHEMBL9329265

CCOC(CC)OCCc1ccc(-c2ccc(C(=O)O)cc2)cc1

nearest known ligand 0.54

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
RARB P10826 11/20 0.54
ALDH1A1 P00352 2/20 0.51
MEN1 O00255 1/20 0.51
RARA P10276 1/20 0.51
MAPT P10636 1/20 0.51
MTOR P42345 1/20 0.51
KMT2A Q03164 1/20 0.51
RXRA P19793 2/20 0.44
RXRB P28702 2/20 0.44
SRD5A2 P31213 2/20 0.44
BCL2 P10415 1/20 0.41
NPC1 O15118 1/20 0.41
TP53 P04637 1/20 0.41
RAB9A P51151 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41

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
SCHEMBL9252735 0.79 RARB (0.57) RARBALDH1A1MEN1RARAMAPT
SCHEMBL14018524 0.78 ALDH1A1 (0.50) RARBALDH1A1MEN1RARAMAPT
SCHEMBL9618261 0.76 RARB (0.63) RARBALDH1A1MEN1RARAMAPT
SCHEMBL985544 0.76 KMT2A (0.50) RARBALDH1A1MEN1RARAMAPT
SCHEMBL9260096 0.75 KMT2A (0.44) MAPTKMT2A
SCHEMBL9329259 0.75 SRD5A2 (0.44) RARBMAPTRXRARXRBSRD5A2
SCHEMBL9328524 0.75 RARB (0.66) RARBALDH1A1MEN1RARAMAPT
SCHEMBL986621 0.74 ALDH1A1 (0.57) RARBALDH1A1MEN1RARAMAPT
SCHEMBL200372 0.73 RARB (0.79) RARBALDH1A1MEN1RARAMAPT
SCHEMBL9260814 0.72 RARB (0.50) RARBALDH1A1MEN1RARAMAPT

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