SCHEMBL12736734

SCHEMBL12736734

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

nearest known ligand 0.38

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 1/20 0.38
ALOX5AP P20292 5/20 0.34
FEN1 P39748 5/20 0.34
FGFR1 P11362 1/20 0.33
FGFR2 P21802 1/20 0.33
FPR2 P25090 2/20 0.32
ADORA3 P0DMS8 1/20 0.32
FFAR4 Q5NUL3 2/20 0.32
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
RET P07949 1/20 0.31
HTR1A P08908 1/20 0.31
ESR1 P03372 1/20 0.31
SSTR5 P35346 1/20 0.30
KDM4E B2RXH2 1/20 0.30
ALDH1A1 P00352 1/20 0.30
HPGD P15428 1/20 0.30
HTT P42858 1/20 0.30
HSD17B10 Q99714 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
SCHEMBL12740309 1.00 NAAA (0.38) NAAAALOX5APFEN1FGFR1FGFR2
SCHEMBL12740310 0.92 FFAR4 (0.34) NAAAALOX5APFEN1FPR2FFAR4
SCHEMBL12736737 0.92 FFAR4 (0.34) NAAAALOX5APFEN1FPR2FFAR4
SCHEMBL14765827 0.92 NAAA (0.38) NAAAALOX5APFEN1FGFR1FGFR2
SCHEMBL14766585 0.92 NAAA (0.38) NAAAALOX5APFEN1FGFR1FGFR2
SCHEMBL12736740 0.91 NAAA (0.32) NAAAALOX5APFEN1FPR2FFAR4
SCHEMBL12740311 0.91 NAAA (0.32) NAAAALOX5APFEN1FPR2FFAR4
SCHEMBL12740301 0.91 NAAA (0.38) NAAAALOX5APFEN1FGFR1FGFR2
SCHEMBL12736726 0.91 NAAA (0.38) NAAAALOX5APFEN1FGFR1FGFR2
SCHEMBL12740313 0.90 NAAA (0.32) NAAAALOX5APFEN1FPR2FFAR4

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 3997/4885ALOX5AP 1673/4885FEN1 3340/4885

“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.