SCHEMBL11939325

SCHEMBL11939325

CCCC(O)c1ccc(OCC2CCC(c3ccc(-c4ccc(OCC)c(F)c4F)c(F)c3F)CC2)c(F)c1F

nearest known ligand 0.45

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ CNR2 P34972 10/20 0.36
▸ ALOX5AP P20292 3/20 0.35
▸ FEN1 P39748 3/20 0.35
▸ CNR1 P21554 3/20 0.34
▸ SCN9A Q15858 2/20 0.34

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
SCHEMBL11939353 1.00 CNR2 (0.36) CNR2ALOX5APFEN1CNR1SCN9A
SCHEMBL12223906 0.97 CNR2 (0.34) CNR2ALOX5APFEN1CNR1SCN9A
SCHEMBL10302857 0.96 CNR2 (0.38) CNR2ALOX5APFEN1CNR1SCN9A
SCHEMBL12223491 0.96 CNR2 (0.38) CNR2ALOX5APFEN1CNR1SCN9A
SCHEMBL11939931 0.94 CNR2 (0.34) CNR2ALOX5APFEN1CNR1
SCHEMBL11939170 0.94 CNR2 (0.34) CNR2ALOX5APFEN1CNR1
SCHEMBL11939128 0.94 FPR2 (0.34) ALOX5APFEN1
SCHEMBL12223321 0.93 GPR119 (0.34) CNR2ALOX5APFEN1CNR1SCN9A
SCHEMBL12223510 0.93 GPR119 (0.34) CNR2ALOX5APFEN1CNR1SCN9A
SCHEMBL10091383 0.93 CNR2 (0.36) CNR2ALOX5APFEN1CNR1SCN9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120168677-A1 LIQUID CRYSTAL COMPOUND, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE JNC PETROCHEMICAL CORPORATION (JP) 2012-07-05 — — 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-20120168677-A1 LIQUID CRYSTAL COMPOUND, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE CXCR1, OCIAD1, LEO1 CNR2 474/4885ALOX5AP 903/4885FEN1 1475/4885

“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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