SCHEMBL9328524

SCHEMBL9328524

CCCOCCc1ccc(-c2ccc(C(=O)O)cc2)cc1

nearest known ligand 0.66

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
RARB P10826 11/20 0.66
ALDH1A1 P00352 2/20 0.62
MEN1 O00255 1/20 0.62
RARA P10276 1/20 0.62
MAPT P10636 1/20 0.62
MTOR P42345 1/20 0.62
KMT2A Q03164 1/20 0.62
RXRA P19793 1/20 0.50
RXRB P28702 1/20 0.50
NPC1 O15118 2/20 0.49
RAB9A P51151 2/20 0.49
SMN1; SMN2 Q16637 2/20 0.49
TP53 P04637 1/20 0.49
BCL2 P10415 1/20 0.46
NFKB1 P19838 1/20 0.46
NFKB2 Q00653 1/20 0.46
RELA Q04206 1/20 0.46
CSNK2A2 P19784 1/20 0.45
CSNK2A1 P68400 1/20 0.45

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
SCHEMBL3656274 0.95 RARB (0.57) RARBALDH1A1MEN1RARAMAPT
SCHEMBL9330520 0.88 RARB (0.73) RARBALDH1A1MEN1RARAMAPT
SCHEMBL10866701 0.85 RARB (0.63) RARBALDH1A1MEN1RARAMAPT
Terephthalic Acid SCHEMBL5179959 0.84 RARB (0.57) RARBALDH1A1KMT2ASMN1; SMN2TP53
SCHEMBL9260821 0.84 RARB (0.64) RARBALDH1A1MEN1RARAMAPT
SCHEMBL986621 0.83 ALDH1A1 (0.57) RARBALDH1A1MEN1RARAMAPT
SCHEMBL200372 0.83 RARB (0.79) RARBALDH1A1MEN1RARAMAPT
SCHEMBL9252748 0.83 RARB (0.62) RARBALDH1A1MEN1RARAMAPT
SCHEMBL8775067 0.83 RARB (0.65) RARBALDH1A1MEN1RARAMAPT
SCHEMBL14672531 0.83 RARB (0.65) 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 1 patent. 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