SCHEMBL8932755

SCHEMBL8932755

CCCCCC1CCC(COc2ccc(-c3ccc(-c4ccc(OCC)c(F)c4F)cc3)c(F)c2)CC1

nearest known ligand 0.39

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
FFAR4 Q5NUL3 2/20 0.39
PPARD Q03181 7/20 0.37
FFAR1 O14842 6/20 0.37
S1PR1 P21453 2/20 0.36
S1PR3 Q99500 2/20 0.36
PDK2 Q15119 1/20 0.35
KDM1A O60341 2/20 0.35
SSTR5 P35346 1/20 0.35
KCNH2 Q12809 1/20 0.35
PARP10 Q53GL7 2/20 0.35
PARP15 Q460N3 1/20 0.35
SCN9A Q15858 1/20 0.35
PPARA Q07869 1/20 0.34
PTGES O14684 1/20 0.33
ALOX5 P09917 1/20 0.33
PPARG P37231 1/20 0.33
PSEN1 P49768 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
SCHEMBL22277198 0.92 SSTR5 (0.37) FFAR4PPARDFFAR1PDK2KDM1A
SCHEMBL8932793 0.89 GRM2 (0.35) FFAR4SSTR5KCNH2
SCHEMBL8970464 0.88 FFAR4 (0.33) FFAR4PPARDFFAR1S1PR1S1PR3
SCHEMBL22277524 0.88 FFAR4 (0.40) FFAR4PPARDFFAR1PDK2KDM1A
SCHEMBL8932785 0.87 FFAR4 (0.38) FFAR4PPARDFFAR1S1PR1KDM1A
SCHEMBL12113866 0.86 FFAR4 (0.41) FFAR4PPARDFFAR1KDM1A
SCHEMBL8932589 0.84 KDM1A (0.38) FFAR4S1PR3KDM1A
SCHEMBL9191579 0.84 S1PR1 (0.46) FFAR4PPARDFFAR1S1PR1S1PR3
SCHEMBL9191576 0.84 S1PR1 (0.46) FFAR4PPARDFFAR1S1PR1S1PR3
SCHEMBL22277469 0.84 FFAR4 (0.39) FFAR4PPARDFFAR1PDK2KDM1A

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-2206695-B1 TETRA- OR PENTA-CYCLIC LIQUID CRYSTALLINE COMPOUND HAVING LATERAL FLUORINE, LIQUID CRYSTAL COMPOSITION, AND LIQUID CRYSTAL DISPLAY ELEMENT JNC CORP (JP) 2013-09-18 EP disclosed
US-8187494-B2 Four- or five-ring liquid crystal compound having lateral fluorine, liquid crystal composition, and liquid crystal display device JNC CORPORATION (JP) 2012-05-29 US disclosed
US-20100309402-A1 FOUR- OR FIVE-RING LIQUID CRYSTAL COMPOUND HAVING LATERAL FLUORINE, LIQUID CRYSTAL COMPOSITION, AND LIQUID CRYSTAL DISPLAY DEVICE CHISSO CORPORATION (JP) 2010-12-09 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-20100309402-A1 FOUR- OR FIVE-RING LIQUID CRYSTAL COMPOUND HAVING LATERAL FLUORINE, LIQUID CRYSTAL COMPOSITION, AND LIQUID CRYSTAL DISPLAY DEVICE KIF23, HCN3, FZD7 FFAR4 342/4885PPARD 2524/4885FFAR1 1401/4885

“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.