SCHEMBL10303247

SCHEMBL10303247

C=CCOc1ccc(C2CCC(COc3ccc(C(C)O)c(F)c3F)CC2)c(F)c1

nearest known ligand 0.39

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ FFAR1 O14842 10/20 0.39
▸ PDE4D Q08499 1/20 0.37
▸ ACACB O00763 3/20 0.34
▸ CNR2 P34972 1/20 0.33
▸ PPARD Q03181 1/20 0.33
▸ CYP2D6 P10635 1/20 0.33
▸ GPR119 Q8TDV5 1/20 0.33

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
SCHEMBL10303246 0.91 FFAR1 (0.38) FFAR1ACACBPPARDGPR119
SCHEMBL13653969 0.90 FFAR1 (0.42) FFAR1PDE4DACACBCNR2PPARD
SCHEMBL10303255 0.89 FFAR1 (0.39) FFAR1PDE4DACACBPPARD
SCHEMBL10303172 0.88 HTR2C (0.35) FFAR1PDE4DCNR2CYP2D6
SCHEMBL10303400 0.88 CYP2D6 (0.38) FFAR1CYP2D6
SCHEMBL12821840 0.88 FFAR1 (0.40) FFAR1PDE4DACACBCNR2PPARD
SCHEMBL12821799 0.86 PDE4D (0.38) FFAR1PDE4DACACBPPARD
SCHEMBL10302388 0.85 FFAR1 (0.38) FFAR1PDE4DACACBPPARD
SCHEMBL12735945 0.85 SCN9A (0.40) FFAR1PDE4DPPARD
SCHEMBL10303065 0.84 FFAR1 (0.33) FFAR1CYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8216489-B2 Three-ring liquid crystal compound having lateral fluorine, liquid crystal composition, and liquid crystal display device JNC CORPORATION (JP) 2012-07-10 — — US disclosed
US-20110037024-A1 THREE-RING LIQUID CRYSTAL COMPOUND HAVING LATERAL FLUORINE, LIQUID CRYSTAL COMPOSITION, AND LIQUID CRYSTAL DISPLAY DEVICE CHISSO CORPORATION (JP) 2011-02-17 — — US disclosed
EP-2266941-A1 TRICYCLIC LIQUID CRYSTALLINE COMPOUND HAVING LATERAL FLUORINE, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE Chisso Corporation (JP) 2010-12-29 — — EP disclosed
WO-2009125668-A1 TRICYCLIC LIQUID CRYSTALLINE COMPOUND HAVING LATERAL FLUORINE, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE チッソ株式会社 (JP) 2009-10-15 — — 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-20110037024-A1 THREE-RING LIQUID CRYSTAL COMPOUND HAVING LATERAL FLUORINE, LIQUID CRYSTAL COMPOSITION, AND LIQUID CRYSTAL DISPLAY DEVICE LEF1, LAS1L, L3MBTL3 FFAR1 681/4885PDE4D 2892/4885ACACB 3911/4885

“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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