SCHEMBL20111277

SCHEMBL20111277

CCCc1ccc2c(c1F)-c1c-2cc(C2CCC(OCC3CCCCC3)CC2)c(F)c1F

nearest known ligand 0.33

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
HCRTR2 O43614 4/20 0.33
ALOX5AP P20292 1/20 0.32
FEN1 P39748 1/20 0.32
GPR119 Q8TDV5 3/20 0.32
SCN9A Q15858 2/20 0.32
SCN5A Q14524 1/20 0.32

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
SCHEMBL20117716 0.91 SCN9A (0.32) HCRTR2GPR119SCN9A
SCHEMBL20102552 0.88 GPR119 (0.32) HCRTR2GPR119
SCHEMBL20111304 0.86 EPHX2 (0.36) ALOX5APFEN1
SCHEMBL20111291 0.81 CTSL (0.35) ALOX5APFEN1SCN9ASCN5A
SCHEMBL20111606 0.80 CTSK (0.36)
SCHEMBL20102430 0.80 MEN1 (0.34)
SCHEMBL20102425 0.80 CTSL (0.30)
SCHEMBL20111648 0.78 ESR2 (0.35)
SCHEMBL20102416 0.78 GAA (0.32)
SCHEMBL20111274 0.77 EPHX2 (0.34) ALOX5APFEN1

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-10323187-B2 Liquid crystal compound having biphenylene, liquid crystal composition and liquid crystal display device JNC CORPORATION (JP) 2019-06-18 US disclosed
US-20180119009-A1 LIQUID CRYSTAL COMPOUND HAVING BIPHENYLENE, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE JNC CORPORATION (JP) 2018-05-03 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 (2 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-20180119009-A1 LIQUID CRYSTAL COMPOUND HAVING BIPHENYLENE, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE YBX1, PIEZO1, C1S HCRTR2 1260/4885ALOX5AP 2002/4885FEN1 1547/4885
US-10323187-B2 Liquid crystal compound having biphenylene, liquid crystal composition and liquid crystal display device YBX1, PIEZO1, C1S HCRTR2 1260/4885ALOX5AP 2002/4885FEN1 1547/4885

“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.