SCHEMBL12740375

SCHEMBL12740375

C=CCCCOc1ccc(COC2CCC(c3ccc(-c4ccc(C)cc4)c(F)c3F)CC2)c(F)c1

nearest known ligand 0.34

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
FFAR4 Q5NUL3 4/20 0.34
CYP2C9 P11712 6/20 0.34
MOGAT2 Q3SYC2 6/20 0.34
NAAA Q02083 4/20 0.32
ALDH2 P05091 1/20 0.32
MAOA P21397 1/20 0.32
MAOB P27338 1/20 0.32
HTR6 P50406 1/20 0.31
FFAR1 O14842 3/20 0.31
ALOX5AP P20292 2/20 0.31
FEN1 P39748 2/20 0.31

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
SCHEMBL12740371 0.96 CYP2C9 (0.34) FFAR4CYP2C9MOGAT2NAAAHTR6
SCHEMBL14766732 0.93 FFAR4 (0.34) FFAR4NAAAALDH2MAOAMAOB
SCHEMBL12736861 0.93 FFAR4 (0.34) FFAR4CYP2C9MOGAT2ALDH2MAOA
SCHEMBL12740370 0.91 FFAR4 (0.34) FFAR4NAAAALDH2MAOAMAOB
SCHEMBL12740364 0.91 FFAR4 (0.36) FFAR4CYP2C9MOGAT2NAAAFFAR1
SCHEMBL14767254 0.90 FFAR4 (0.34) FFAR4NAAAFFAR1ALOX5APFEN1
SCHEMBL12733968 0.90 FFAR4 (0.35) FFAR4CYP2C9MOGAT2ALDH2MAOA
SCHEMBL14766870 0.90 FFAR4 (0.35) FFAR4NAAAFFAR1ALOX5APFEN1
SCHEMBL12736858 0.90 FFAR4 (0.33) FFAR4CYP2C9MOGAT2FFAR1ALOX5AP
SCHEMBL12740365 0.89 FFAR4 (0.35) FFAR4CYP2C9MOGAT2NAAAFFAR1

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-8394294-B2 Four-ring liquid crystal compound having lateral fluorine, liquid crystal composition and liquid crystal display device JNC CORPORATION (JP) 2013-03-12 US disclosed
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

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 FFAR4 546/4885CYP2C9 2816/4885MOGAT2 992/4885

“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.