SCHEMBL8072295

SCHEMBL8072295

CCC(C)COc1cc(CC(=O)O)cc(OCC(C)CC)c1OCC(C)CC

nearest known ligand 0.54

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
THRB P10828 9/20 0.54
THRA P10827 8/20 0.54
FFAR1 O14842 1/20 0.42
GAA P10253 2/20 0.39
ALDH1A1 P00352 1/20 0.39
TSHR P16473 1/20 0.39
NFKB1 P19838 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
MAPT P10636 1/20 0.38
PTGDR2 Q9Y5Y4 1/20 0.36
ITGB3 P05106 1/20 0.36
ITGAV P06756 1/20 0.36
RXRA P19793 1/20 0.36
PPARG P37231 1/20 0.36
SLC22A12 Q96S37 1/20 0.36
TLR8 Q9NR97 1/20 0.36

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
SCHEMBL8080653 0.81 MAPT (0.50) FFAR1TSHRTDP1MAPTRXRA
SCHEMBL8072296 0.77 ALOX5 (0.43) FFAR1GAAALDH1A1TSHRMAPT
SCHEMBL8081319 0.75 FFAR1 (0.61) FFAR1ALDH1A1TSHRNFKB1TDP1
SCHEMBL8086411 0.72 THRB (0.49) THRBTHRAGAAALDH1A1TSHR
SCHEMBL12215167 0.71 THRB (0.71) THRBTHRAALDH1A1
SCHEMBL15270918 0.71 THRB (0.71) THRBTHRAALDH1A1
SCHEMBL8080300 0.70 POLB (0.41) TSHRMAPT
SCHEMBL4888327 0.70 THRB (1.00) THRBTHRATSHRPPARG
SCHEMBL4898133 0.69 THRB (0.73) THRBTHRATSHRPPARG
SCHEMBL8086406 0.68 TSHR (0.56) GAAALDH1A1TSHRMAPT

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