SCHEMBL9260988

SCHEMBL9260988

CCCCCCC(C)OCCc1ccc(C(=O)O)cc1

nearest known ligand 0.61

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
RARB P10826 9/20 0.57
ALDH1A1 P00352 2/20 0.57
MEN1 O00255 1/20 0.57
RARA P10276 1/20 0.57
MAPT P10636 1/20 0.57
MTOR P42345 1/20 0.57
KMT2A Q03164 1/20 0.57
TP53 P04637 1/20 0.51
TSHR P16473 1/20 0.51
PLA2G4B P0C869 2/20 0.50
PLA2G1B P04054 3/20 0.47
ATG4B Q9Y4P1 3/20 0.47
THRA P10827 1/20 0.47
THRB P10828 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
SCHEMBL9260994 1.00 RARB (0.57) RARBALDH1A1MEN1RARAMAPT
SCHEMBL9257178 0.95 RARB (0.61) RARBALDH1A1MEN1RARAMAPT
SCHEMBL9257180 0.95 RARB (0.61) RARBALDH1A1MEN1RARAMAPT
SCHEMBL9261332 0.89 THRA (0.46) RARBPLA2G1BATG4BTHRATHRB
SCHEMBL8149147 0.89 RARB (0.57) RARBALDH1A1MEN1RARAMAPT
SCHEMBL9260814 0.89 RARB (0.50) RARBALDH1A1MEN1RARAMAPT
SCHEMBL9261896 0.86 ALDH1A1 (0.59) ALDH1A1PLA2G4BPLA2G1BATG4BTHRA
SCHEMBL9261889 0.86 ALDH1A1 (0.59) ALDH1A1PLA2G4BPLA2G1BATG4BTHRA
SCHEMBL20427410 0.86 RARB (0.52) RARBALDH1A1MEN1RARAMAPT
SCHEMBL9252643 0.85 RARB (0.56) 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-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