SCHEMBL12734656

SCHEMBL12734656

CCCCCCCCOc1ccc(-c2ccc(/C=C/c3ccc(-c4ccc(C)cc4)c(F)c3F)cc2)c(F)c1F

nearest known ligand 0.36

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
NFE2L2 Q16236 6/20 0.36
ALDH1A1 P00352 2/20 0.35
MAPT P10636 2/20 0.35
NPSR1 Q6W5P4 2/20 0.35
GAA P10253 1/20 0.35
THRB P10828 1/20 0.35
PTPN11 Q06124 5/20 0.33
APP P05067 1/20 0.33
HDAC8 Q9BY41 1/20 0.32
AHR P35869 1/20 0.32
HPGD P15428 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
CNR2 P34972 1/20 0.31
KCNA3 P22001 1/20 0.31
HDAC1 Q13547 1/20 0.31
PTPN1 P18031 1/20 0.31
PTPN6 P29350 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
SCHEMBL12739535 1.00 NFE2L2 (0.36) NFE2L2ALDH1A1MAPTNPSR1GAA
SCHEMBL12739528 1.00 NFE2L2 (0.36) NFE2L2ALDH1A1MAPTNPSR1GAA
SCHEMBL12734655 1.00 NFE2L2 (0.36) NFE2L2ALDH1A1MAPTNPSR1GAA
SCHEMBL12739530 1.00 NFE2L2 (0.36) NFE2L2ALDH1A1MAPTNPSR1GAA
SCHEMBL12734646 1.00 NFE2L2 (0.36) NFE2L2ALDH1A1MAPTNPSR1GAA
SCHEMBL12734624 0.99 NFE2L2 (0.36) NFE2L2ALDH1A1MAPTNPSR1GAA
SCHEMBL12739527 0.99 NFE2L2 (0.36) NFE2L2ALDH1A1MAPTNPSR1GAA
SCHEMBL12739524 0.95 NFE2L2 (0.37) NFE2L2ALDH1A1MAPTNPSR1APP
SCHEMBL12734621 0.95 NFE2L2 (0.37) NFE2L2ALDH1A1MAPTNPSR1APP
SCHEMBL10301678 0.92 PTPN11 (0.33) NFE2L2ALDH1A1MAPTNPSR1GAA

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 NFE2L2 1574/4885ALDH1A1 1480/4885MAPT 1075/4885

“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.