SCHEMBL11939218

SCHEMBL11939218

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

nearest known ligand 0.36

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ FPR2 P25090 5/20 0.35
▸ PTGS1 P23219 1/20 0.33
▸ PTGS2 P35354 1/20 0.33
▸ ALOX5AP P20292 6/20 0.32
▸ FEN1 P39748 6/20 0.32
▸ PDE2A O00408 1/20 0.32
▸ PDE4A P27815 1/20 0.31
▸ PDE4B Q07343 1/20 0.31
▸ PDE4C Q08493 1/20 0.31
▸ PDE4D Q08499 1/20 0.31
▸ ACACB O00763 1/20 0.31
▸ IDO1 P14902 1/20 0.31
▸ KDM1A O60341 2/20 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
SCHEMBL12223836 0.96 FPR2 (0.34) FPR2PTGS1PTGS2ALOX5APFEN1
SCHEMBL11939058 0.93 CNR2 (0.39) ALOX5APFEN1
SCHEMBL11939167 0.93 CNR2 (0.39) ALOX5APFEN1
SCHEMBL11939822 0.91 NAAA (0.33) FPR2ALOX5APFEN1ACACB
SCHEMBL11939128 0.91 FPR2 (0.34) FPR2ALOX5APFEN1PDE4APDE4B
SCHEMBL11939171 0.90 HPGD (0.38) FPR2PTGS1PTGS2ALOX5APFEN1
SCHEMBL11939364 0.90 HPGD (0.38) FPR2PTGS1PTGS2ALOX5APFEN1
SCHEMBL11939217 0.89 FPR2 (0.36) FPR2PTGS1PTGS2ALOX5APFEN1
SCHEMBL11939320 0.89 CTSL (0.30) FPR2
SCHEMBL12224656 0.89 SMN1; SMN2 (0.34) FPR2PTGS1PTGS2ALOX5APFEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2479162-A1 LIQUID CRYSTALLINE COMPOUND, LIQUID CRYSTAL COMPOSITION, AND LIQUID CRYSTAL DISPLAY ELEMENT JNC Corporation (JP) 2012-07-25 — — EP disclosed
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 804/4885PTGS1 3289/4885PTGS2 4058/4885

“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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