SCHEMBL12719084

SCHEMBL12719084

COc1ccc(COc2ccc(-c3ccc(C4CCC(OC)CC4)c(F)c3F)cc2)c(F)c1F

nearest known ligand 0.41

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
FFAR4 Q5NUL3 6/20 0.41
ALOX5AP P20292 4/20 0.36
FEN1 P39748 4/20 0.36
ALDH1A1 P00352 1/20 0.35
GAA P10253 1/20 0.35
GYS1 P13807 5/20 0.34
FPR2 P25090 1/20 0.34
PTGER4 P35408 1/20 0.33

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
SCHEMBL12821394 1.00 FFAR4 (0.41) FFAR4ALOX5APFEN1ALDH1A1GAA
SCHEMBL13586316 0.93 FFAR4 (0.38) FFAR4ALOX5APFEN1GYS1FPR2
SCHEMBL13586390 0.93 FFAR4 (0.38) FFAR4ALOX5APFEN1GYS1FPR2
SCHEMBL12736898 0.90 FFAR4 (0.41) FFAR4ALOX5APFEN1ALDH1A1GAA
SCHEMBL12736882 0.90 FFAR4 (0.40) FFAR4ALOX5APFEN1ALDH1A1GAA
SCHEMBL12740391 0.90 FFAR4 (0.41) FFAR4ALOX5APFEN1ALDH1A1GAA
SCHEMBL12740384 0.90 FFAR4 (0.40) FFAR4ALOX5APFEN1ALDH1A1GAA
SCHEMBL13586317 0.90 FFAR4 (0.39) FFAR4ALOX5APFEN1
SCHEMBL13586417 0.90 FFAR4 (0.39) FFAR4ALOX5APFEN1
SCHEMBL12822946 0.88 FFAR4 (0.38) FFAR4ALOX5APFEN1GYS1

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-8394294-B2 Four-ring liquid crystal compound having lateral fluorine, liquid crystal composition and liquid crystal display device JNC CORPORATION (JP) 2013-03-12 US disclosed
US-20110090450-A1 FOUR-RING LIQUID CRYSTAL COMPOUND HAVING LATERAL FLUORINE, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE JNC CORPORATION (JP) 2011-04-21 US disclosed
EP-2305627-A1 TETRACYCLIC LIQUID CRYSTALLINE COMPOUND HAVING LATERAL FLUORINE, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY ELEMENT Chisso Corporation (JP) 2011-04-06 EP disclosed
WO-2009150966-A1 TETRACYCLIC LIQUID CRYSTALLINE COMPOUND HAVING LATERAL FLUORINE, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY ELEMENT チッソ株式会社 (JP) 2009-12-17 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-20110090450-A1 FOUR-RING LIQUID CRYSTAL COMPOUND HAVING LATERAL FLUORINE, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE LEF1, LAS1L, EFHD2 FFAR4 546/4885ALOX5AP 1673/4885FEN1 3340/4885

“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.