SCHEMBL17359271

SCHEMBL17359271

CCCC1CCC(c2ccc(-c3ccc(OCF)c(F)c3)c(F)c2F)CC1

nearest known ligand 0.35

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
FFAR4 Q5NUL3 5/20 0.34
FPR2 P25090 2/20 0.34
ALOX5AP P20292 2/20 0.32
FEN1 P39748 2/20 0.32
OPRL1 P41146 3/20 0.32
GRM2 Q14416 3/20 0.32
GRIN1 Q05586 1/20 0.32
GRIN2B Q13224 1/20 0.32
DGAT1 O75907 1/20 0.32
NAAA Q02083 1/20 0.31
HPGD P15428 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
SCHEMBL17356607 0.89 FPR2 (0.39) FPR2ALOX5APFEN1GRIN1GRIN2B
SCHEMBL17356590 0.85 OPRL1 (0.37) FFAR4OPRL1DGAT1
SCHEMBL13666233 0.84 FFAR4 (0.39) FFAR4FPR2ALOX5APFEN1OPRL1
SCHEMBL18310424 0.83 CYP2C9 (0.38) FFAR4ALOX5APFEN1GRM2NAAA
SCHEMBL17359242 0.83 OPRL1 (0.33) FFAR4OPRL1DGAT1
SCHEMBL17356598 0.83 OPRL1 (0.38) OPRL1DGAT1
SCHEMBL8934887 0.83 FPR2 (0.35) FFAR4FPR2ALOX5APFEN1GRIN1
SCHEMBL12739993 0.83 FFAR4 (0.38) FFAR4FPR2NAAA
SCHEMBL12740893 0.83 FEN1 (0.36) FFAR4ALOX5APFEN1GRM2
SCHEMBL17356553 0.82 OPRL1 (0.37) OPRL1DGAT1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9527870-B2 Liquid crystal compound, liquid crystal composition and liquid crystal display device JNC CORPORATION (JP) 2016-12-27 US disclosed
US-20150368272-A1 LIQUID CRYSTAL COMPOUND, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE JNC PETROCHEMICAL CORPORATION (JP) 2015-12-24 US 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-20150368272-A1 LIQUID CRYSTAL COMPOUND, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE YBX3, OCIAD1, PIEZO1 FFAR4 2055/4885FPR2 1454/4885ALOX5AP 1818/4885

“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.