SCHEMBL12736736

SCHEMBL12736736

CCOc1ccc(C2CCC(OCc3ccc(-c4ccc(CO)cc4)c(F)c3F)CC2)c(F)c1F

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 2/20 0.37
FFAR4 Q5NUL3 3/20 0.35
ALOX5AP P20292 3/20 0.34
FEN1 P39748 3/20 0.34
FPR2 P25090 2/20 0.33
S1PR1 P21453 2/20 0.33
S1PR3 Q99500 2/20 0.33
SSTR5 P35346 2/20 0.33
FGFR1 P11362 1/20 0.32
FGFR2 P21802 1/20 0.32
RET P07949 1/20 0.32
GABRA1 P14867 1/20 0.32
GABRG2 P18507 1/20 0.32
GABRB3 P28472 1/20 0.32
GABRA5 P31644 1/20 0.32
GABRA3 P34903 1/20 0.32
GABRA2 P47869 1/20 0.32
ESR1 P03372 1/20 0.32
CHKA P35790 1/20 0.31
HTT P42858 1/20 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
SCHEMBL12740307 1.00 NAAA (0.37) NAAAFFAR4ALOX5APFEN1FPR2
SCHEMBL12740301 0.93 NAAA (0.38) NAAAFFAR4ALOX5APFEN1FPR2
SCHEMBL12736726 0.93 NAAA (0.38) NAAAFFAR4ALOX5APFEN1FPR2
SCHEMBL12736719 0.91 NAAA (0.37) NAAAFFAR4ALOX5APFEN1FPR2
SCHEMBL12740302 0.91 NAAA (0.37) NAAAFFAR4ALOX5APFEN1FPR2
SCHEMBL12736729 0.91 NAAA (0.38) NAAAFFAR4ALOX5APFEN1FPR2
SCHEMBL12740306 0.91 NAAA (0.38) NAAAFFAR4ALOX5APFEN1FPR2
SCHEMBL12733876 0.90 S1PR1 (0.39) FFAR4ALOX5APFEN1FPR2S1PR1
SCHEMBL12740309 0.90 NAAA (0.38) NAAAFFAR4ALOX5APFEN1FPR2
SCHEMBL14765827 0.90 NAAA (0.38) NAAAFFAR4ALOX5APFEN1FPR2

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 NAAA 3997/4885FFAR4 546/4885ALOX5AP 1673/4885

“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.