SCHEMBL8086437

SCHEMBL8086437

CCCC(C)Oc1cc(CC(=O)O)cc(OC(C)CCC)c1OC(C)CCC

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
THRB P10828 13/20 0.47
THRA P10827 12/20 0.47
ALDH1A1 P00352 3/20 0.39
GAA P10253 2/20 0.39
TSHR P16473 1/20 0.39
NFKB1 P19838 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
RXRA P19793 2/20 0.36
PPARG P37231 2/20 0.36
ITGB3 P05106 1/20 0.36
ITGAV P06756 1/20 0.36
RXRB P28702 1/20 0.36
RXRG P48443 1/20 0.36
HPGD P15428 1/20 0.36
HSD17B10 Q99714 1/20 0.36
CCNB2 O95067 1/20 0.36
CCNE2 O96020 1/20 0.36
CDK1 P06493 1/20 0.36
CCNB1 P14635 1/20 0.36
CCNE1 P24864 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
SCHEMBL8082037 0.94 GAA (0.44) THRBTHRAALDH1A1GAATSHR
SCHEMBL8080243 0.91 THRB (0.50) THRBTHRAALDH1A1GAATSHR
SCHEMBL8081329 0.90 THRB (0.51) THRBTHRAALDH1A1GAATSHR
SCHEMBL8086395 0.89 THRB (0.52) THRBTHRAALDH1A1HPGDHSD17B10
SCHEMBL8080237 0.89 THRB (0.52) THRBTHRAALDH1A1HPGDHSD17B10
SCHEMBL8086411 0.88 THRB (0.49) THRBTHRAALDH1A1GAATSHR
SCHEMBL8081496 0.86 THRB (0.46) THRBTHRAALDH1A1GAATSHR
SCHEMBL8081688 0.85 THRB (0.47) THRBTHRAALDH1A1GAATSHR
SCHEMBL8081661 0.84 ALDH1A1 (0.48) ALDH1A1GAATSHRNFKB1TDP1
SCHEMBL8072258 0.82 GAA (0.47) THRBTHRAALDH1A1GAATSHR

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