SCHEMBL11939217

SCHEMBL11939217

CCOc1ccc(-c2ccc(C3CCC(c4ccc(C(C)O)c(F)c4F)CC3)c(F)c2F)c(F)c1F

nearest known ligand 0.36

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ FPR2 P25090 4/20 0.36
▸ ALOX5AP P20292 5/20 0.34
▸ FEN1 P39748 5/20 0.34
▸ PTGS1 P23219 1/20 0.33
▸ PTGS2 P35354 1/20 0.33
▸ ACACB O00763 3/20 0.33
▸ S1PR1 P21453 3/20 0.32
▸ S1PR2 O95136 1/20 0.32
▸ S1PR4 O95977 1/20 0.32
▸ S1PR3 Q99500 1/20 0.32
▸ S1PR5 Q9H228 1/20 0.32
▸ TP53 P04637 1/20 0.32
▸ LMNA P02545 1/20 0.32
▸ HTT P42858 1/20 0.32
▸ SMN1; SMN2 Q16637 1/20 0.32

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
SCHEMBL12223936 0.96 FPR2 (0.34) FPR2ALOX5APFEN1PTGS1PTGS2
SCHEMBL10303398 0.95 TP53 (0.34) FPR2ALOX5APFEN1ACACBTP53
SCHEMBL12223403 0.95 TP53 (0.34) FPR2ALOX5APFEN1ACACBTP53
SCHEMBL12223974 0.94 FPR2 (0.33) FPR2ALOX5APFEN1PTGS1PTGS2
SCHEMBL11939324 0.93 CNR2 (0.37) ALOX5APFEN1
SCHEMBL11939352 0.93 CNR2 (0.37) ALOX5APFEN1
SCHEMBL11939195 0.90 ACACB (0.34) FPR2ALOX5APFEN1ACACB
SCHEMBL12224609 0.90 GPR119 (0.37) ALOX5APFEN1ACACB
SCHEMBL11939000 0.90 KDM1A (0.37) FPR2PTGS1PTGS2TP53
SCHEMBL12223926 0.90 GPR119 (0.37) ALOX5APFEN1ACACB

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-20120168677-A1 LIQUID CRYSTAL COMPOUND, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE JNC PETROCHEMICAL CORPORATION (JP) 2012-07-05 — — US disclosed
WO-2011033937-A1 LIQUID CRYSTALLINE COMPOUND, LIQUID CRYSTAL COMPOSITION, AND LIQUID CRYSTAL DISPLAY ELEMENT チッソ株式会社 (JP) 2011-03-24 — — 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-20120168677-A1 LIQUID CRYSTAL COMPOUND, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE CXCR1, OCIAD1, LEO1 FPR2 804/4885ALOX5AP 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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