SCHEMBL9927736

SCHEMBL9927736

CCCCCC1CCC(c2ccc(-c3ccc(-c4ccc(C)cc4)c(F)c3F)cc2)CO1

nearest known ligand 0.40

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.40
EPHX1 P07099 1/20 0.35
GRM2 Q14416 2/20 0.35
DGAT1 O75907 1/20 0.34
ALDH1A1 P00352 1/20 0.34
PPARG P37231 1/20 0.32
SPHK1 Q9NYA1 3/20 0.32
CYP1A2 P05177 2/20 0.32
SIRT2 Q8IXJ6 1/20 0.31

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
SCHEMBL10553853 0.88 ALOX5 (0.49) ALOX5EPHX1GRM2ALDH1A1PPARG
SCHEMBL10552488 0.87 ALOX5 (0.48) ALOX5EPHX1GRM2ALDH1A1PPARG
SCHEMBL10548231 0.87 ALOX5 (0.48) ALOX5EPHX1GRM2ALDH1A1PPARG
SCHEMBL10554476 0.87 ALOX5 (0.48) ALOX5EPHX1GRM2ALDH1A1PPARG
SCHEMBL8943319 0.86 ALOX5 (0.34) ALOX5EPHX1DGAT1ALDH1A1
SCHEMBL9927717 0.85 ALOX5 (0.36) ALOX5EPHX1DGAT1ALDH1A1
SCHEMBL8944143 0.85 EPHX1 (0.34) ALOX5EPHX1GRM2DGAT1ALDH1A1
SCHEMBL9927727 0.84 GRM2 (0.32) EPHX1GRM2ALDH1A1
SCHEMBL10548554 0.84 ALOX5 (0.50) ALOX5EPHX1GRM2ALDH1A1SPHK1
SCHEMBL9927637 0.84 ALOX5 (0.41) ALOX5DGAT1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2468740-B1 TETRAHYDROPYRAN COMPOUNDS, LIQUID CRYSTAL COMPOSITIONS AND LIQUID CRYSTAL DISPLAY DEVICES JNC CORP (JP) 2017-08-02 EP disclosed
US-9663716-B2 Tetrahydropyran compound, liquid crystal composition and liquid crystal display device JNC CORPORATION (JP) 2017-05-30 US disclosed
US-9663716-B2 Tetrahydropyran compound, liquid crystal composition and liquid crystal display device JNC CORPORATION (JP) 2017-05-30 US disclosed
EP-2468740-A1 TETRAHYDROPYRAN COMPOUNDS, LIQUID CRYSTAL COMPOSITIONS AND LIQUID CRYSTAL DISPLAY ELEMENTS JNC Corporation (JP) 2012-06-27 EP disclosed
US-20120145958-A1 TETRAHYDROPYRAN COMPOUND, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE JNC PETROCHEMICAL CORPORATION (JP) 2012-06-14 US disclosed
US-20120145958-A1 TETRAHYDROPYRAN COMPOUND, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE JNC PETROCHEMICAL CORPORATION (JP) 2012-06-14 US disclosed
WO-2011021534-A1 TETRAHYDROPYRAN COMPOUNDS, LIQUID CRYSTAL COMPOSITIONS AND LIQUID CRYSTAL DISPLAY ELEMENTS チッソ株式会社 (JP) 2011-02-24 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20120145958-A1 TETRAHYDROPYRAN COMPOUND, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE DRD1, CCND1, CCND2 ALOX5 2655/4885EPHX1 1495/4885GRM2 285/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.