SCHEMBL17487985

SCHEMBL17487985

CCCCCC1CCC(c2ccc(CCc3ccc(-c4ccc(-c5cc(F)c(F)c(F)c5)c(F)c4)c(F)c3)c(F)c2F)CC1

nearest known ligand 0.34

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
RARB P10826 1/20 0.34
FFAR4 Q5NUL3 1/20 0.33
CYP3A4 P08684 1/20 0.30
CYP2C8 P10632 1/20 0.30
CYP2D6 P10635 1/20 0.30
CYP2C9 P11712 1/20 0.30
CYP2C19 P33261 1/20 0.30
S1PR3 Q99500 1/20 0.30
GAA P10253 1/20 0.30
MAPT P10636 1/20 0.30
FAAH O00519 1/20 0.30
PTGS2 P35354 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
SCHEMBL17487973 0.92 RARB (0.32) RARBFFAR4
SCHEMBL17487872 0.91 OPRL1 (0.31) FFAR4
SCHEMBL17487978 0.91 FFAR4 (0.33) RARBFFAR4GAAMAPT
SCHEMBL17487980 0.90 RARB (0.39) RARBFFAR4CYP3A4CYP2C8CYP2D6
SCHEMBL17487969 0.88 RARB (0.35) RARBFFAR4CYP3A4CYP2C9
SCHEMBL12735444 0.88 RARB (0.43) RARBFFAR4S1PR3
SCHEMBL17487934 0.87 OPRL1 (0.31) FFAR4
SCHEMBL12735443 0.87 RARB (0.39) RARBFFAR4S1PR3
SCHEMBL17490440 0.85 FFAR4 (0.34) FFAR4
SCHEMBL12735452 0.84 FFAR4 (0.37) RARBFFAR4S1PR3

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-9441161-B2 Liquid crystal compound, liquid crystal composition and liquid crystal display device JNC CORPORATION (JP) 2016-09-13 US disclosed
US-20160032187-A1 LIQUID CRYSTAL COMPOUND, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE JNC PETROCHEMICAL CORPORATION (JP) 2016-02-04 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-20160032187-A1 LIQUID CRYSTAL COMPOUND, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE OCIAD1, OCIAD2, PIEZO1 RARB 3736/4885FFAR4 1903/4885CYP3A4 1995/4885

“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.