SCHEMBL12821168

SCHEMBL12821168

CCCC(O)c1ccc(-c2ccc(C3CCC(COc4ccc(C5CO5)c(F)c4F)CC3)c(F)c2F)cc1

nearest known ligand 0.35

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ PDE4B Q07343 3/20 0.33
▸ PDE4A P27815 2/20 0.33
▸ PDE4C Q08493 2/20 0.33
▸ PDE4D Q08499 2/20 0.33
▸ FPR2 P25090 3/20 0.33
▸ CNR2 P34972 1/20 0.32
▸ ALOX5AP P20292 1/20 0.32
▸ FEN1 P39748 1/20 0.32
▸ IL5 P05113 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
SCHEMBL12716540 1.00 PDE4B (0.33) PDE4BPDE4APDE4CPDE4DFPR2
SCHEMBL12822815 0.92 CNR2 (0.34) PDE4BPDE4APDE4CPDE4DFPR2
SCHEMBL12821163 0.89 CNR2 (0.33) PDE4BPDE4APDE4CPDE4DFPR2
SCHEMBL12823829 0.89 CNR2 (0.33) PDE4BPDE4APDE4CPDE4DFPR2
SCHEMBL12822866 0.89 FPR2 (0.34) PDE4BPDE4APDE4CPDE4DFPR2
SCHEMBL13586560 0.89 PDE4B (0.33) PDE4BPDE4APDE4CPDE4DFPR2
SCHEMBL13586122 0.89 FPR2 (0.35) PDE4BFPR2CNR2ALOX5APFEN1
SCHEMBL12836495 0.88 CNR2 (0.33) FPR2CNR2ALOX5APFEN1
SCHEMBL12836038 0.88 CNR2 (0.33) FPR2CNR2ALOX5APFEN1
SCHEMBL12821160 0.87 ALOX5AP (0.32) CNR2ALOX5APFEN1

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-20110090450-A1 FOUR-RING LIQUID CRYSTAL COMPOUND HAVING LATERAL FLUORINE, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE JNC CORPORATION (JP) 2011-04-21 — — US disclosed
WO-2009150966-A1 TETRACYCLIC LIQUID CRYSTALLINE COMPOUND HAVING LATERAL FLUORINE, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY ELEMENT チッソ株式会社 (JP) 2009-12-17 — — 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-20110090450-A1 FOUR-RING LIQUID CRYSTAL COMPOUND HAVING LATERAL FLUORINE, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE LEF1, LAS1L, EFHD2 PDE4B 2984/4885PDE4A 3366/4885PDE4C 3447/4885

“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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