SCHEMBL10091417

SCHEMBL10091417

CCCC(O)c1ccc(-c2ccc(OCC3CCC(c4ccc(C5CO5)c(F)c4F)CC3)cc2)c(F)c1F

nearest known ligand 0.35

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ FFAR1 O14842 9/20 0.33
▸ FFAR4 Q5NUL3 1/20 0.33
▸ ALOX5AP P20292 1/20 0.32
▸ FEN1 P39748 1/20 0.32
▸ GRM2 Q14416 1/20 0.31
▸ SSTR5 P35346 1/20 0.30
▸ KCNH2 Q12809 1/20 0.30

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
SCHEMBL12836037 0.90 FFAR1 (0.37) FFAR1FFAR4
SCHEMBL12836038 0.88 CNR2 (0.33) ALOX5APFEN1
SCHEMBL12836495 0.88 CNR2 (0.33) ALOX5APFEN1
SCHEMBL12836496 0.86 FPR2 (0.33) FFAR4FEN1
SCHEMBL12907074 0.85 FFAR1 (0.38) FFAR1
SCHEMBL12907786 0.85 CNR2 (0.35) FFAR1ALOX5APFEN1
SCHEMBL10091443 0.84 HTT (0.31) —
SCHEMBL12821168 0.84 PDE4B (0.33) ALOX5APFEN1
SCHEMBL12716540 0.84 PDE4B (0.33) ALOX5APFEN1
SCHEMBL12907071 0.83 KCNJ1 (0.31) —

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-20120018672-A1 LIQUID CRYSTAL COMPOUND, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE CHISSO PETROCHEMICAL CORPORATION (JP) 2012-01-26 — — US disclosed
WO-2010082558-A1 LIQUID CRYSTALLINE COMPOUND, LIQUID CRYSTAL COMPOSITION, AND LIQUID CRYSTAL DISPLAY ELEMENT チッソ株式会社 (JP) 2010-07-22 — — 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-20120018672-A1 LIQUID CRYSTAL COMPOUND, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE ROCK2, ROCK1, LEF1 FFAR1 891/4885FFAR4 1689/4885ALOX5AP 2550/4885

“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.

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