SCHEMBL9252748

SCHEMBL9252748

CCCOCCCOCCCCc1ccc(C(=O)O)cc1

nearest known ligand 0.66

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
RARB P10826 10/20 0.62
ALDH1A1 P00352 2/20 0.60
MEN1 O00255 1/20 0.60
RARA P10276 1/20 0.60
MAPT P10636 1/20 0.60
MTOR P42345 1/20 0.60
KMT2A Q03164 1/20 0.60
PLA2G4B P0C869 2/20 0.53
TP53 P04637 1/20 0.50
TSHR P16473 1/20 0.50
NPC1 O15118 1/20 0.48
NFKB1 P19838 1/20 0.48
RAB9A P51151 1/20 0.48
NFKB2 Q00653 1/20 0.48
RELA Q04206 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
SPHK1 Q9NYA1 1/20 0.47

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
SCHEMBL12354617 0.92 RARB (0.73) RARBALDH1A1MEN1RARAMAPT
SCHEMBL12162210 0.92 RARB (0.69) RARBALDH1A1MEN1RARAMAPT
SCHEMBL12162212 0.91 RARB (0.74) RARBALDH1A1MEN1RARAMAPT
SCHEMBL12162213 0.91 RARB (0.74) RARBALDH1A1MEN1RARAMAPT
SCHEMBL9252654 0.89 RARB (0.69) RARBALDH1A1MEN1RARAMAPT
SCHEMBL9259775 0.88 HSD17B10 (0.53) RARBALDH1A1MEN1RARAMAPT
SCHEMBL3656274 0.87 RARB (0.57) RARBALDH1A1MEN1RARAMAPT
SCHEMBL9260821 0.86 RARB (0.64) RARBALDH1A1MEN1RARAMAPT
SCHEMBL8775067 0.84 RARB (0.65) RARBALDH1A1MEN1RARAMAPT
SCHEMBL14672531 0.84 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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5385693-A Having rapid response and low phase transition temperature SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1995-01-31 US disclosed
EP-0357372-B1 Optically active ester derivatives, preparation process thereof, liquid crystal materials and a light switching element SUMITOMO CHEMICAL CO (JP) 1994-11-17 EP disclosed
US-5264151-A Optically active ester derivatives, preparation process thereof, liquid crystal materials and a light switching element SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1993-11-23 US disclosed
US-5124070-A High speed response SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1992-06-23 US disclosed
EP-0357372-A2 Optically active ester derivatives, preparation process thereof, liquid crystal materials and a light switching element SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1990-03-07 EP disclosed