SCHEMBL8086436

SCHEMBL8086436

CCC(C)OC(C(=O)O)c1ccccc1

nearest known ligand 0.49

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 8/20 0.49
PPARG P37231 5/20 0.46
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
LMNA P02545 1/20 0.42
ALDH1A1 P00352 1/20 0.41
CYP3A4 P08684 1/20 0.41
APAF1 O14727 1/20 0.41
MAPT P10636 1/20 0.41
CYP2D6 P10635 1/20 0.41
SRC P12931 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
SCHEMBL8658479 0.85 ALDH1A1 (0.57) PPARAPPARGMEN1KMT2ALMNA
SCHEMBL24327749 0.81 CYP2D6 (0.46) PPARAPPARGKMT2ALMNAALDH1A1
SCHEMBL17724493 0.81 CYP2D6 (0.46) PPARAPPARGKMT2ALMNAALDH1A1
SCHEMBL3940548 0.81 CYP2D6 (0.46) PPARAPPARGKMT2ALMNAALDH1A1
SCHEMBL8400939 0.80 SRC (0.54) PPARAPPARGKMT2ALMNAALDH1A1
SCHEMBL6204041 0.80 NPSR1 (0.53) MEN1KMT2ALMNAALDH1A1CYP3A4
SCHEMBL8971540 0.78 PPARA (0.43) PPARAPPARGLMNAALDH1A1CYP3A4
SCHEMBL21558227 0.76 LMNA (0.52) MEN1KMT2ALMNAALDH1A1CYP3A4
SCHEMBL6504745 0.76 PPARA (0.49) PPARAPPARGLMNAALDH1A1CYP3A4
SCHEMBL9269746 0.76 KDM4E (0.43) PPARAPPARGMEN1KMT2AALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0758013-B1 Liquid crystalline optical film, compensating film for liquid crystal display and liquid crystal display NIPPON OIL CO LTD (JP) 2000-10-11 EP disclosed
US-5855971-A Liquid crystalline optical film, compensating film for liquid crystal display comprising the liquid crystalline optical film, and liquid crystal display having the compensating film NIPPON OIL COMPANY, LIMITED (JP) 1999-01-05 US disclosed
EP-0758013-A1 Liquid crystalline optical film, compensating film for liquid crystal display and liquid crystal display NIPPON OIL COMPANY, LIMITED (JP) 1997-02-12 EP disclosed