SCHEMBL20111515

SCHEMBL20111515

CCCCC1CCC(C2CCC(c3ccc4c(c3F)-c3c-4cc(OCC4CCCCC4)c(F)c3F)CC2)CC1

nearest known ligand 0.36

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ALOX5AP P20292 3/20 0.36
FEN1 P39748 3/20 0.36
SCN9A Q15858 11/20 0.35
SCN5A Q14524 3/20 0.35
CYP1A2 P05177 1/20 0.34
OPRL1 P41146 3/20 0.33

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
SCHEMBL20102611 0.94 ALOX5AP (0.32) ALOX5APFEN1SCN9A
SCHEMBL20117735 0.93 SCN9A (0.36) ALOX5APFEN1SCN9A
SCHEMBL20111364 0.91 ALOX5AP (0.39) ALOX5APFEN1SCN9ASCN5AOPRL1
SCHEMBL20111514 0.90 CYP1A2 (0.37) ALOX5APFEN1CYP1A2
SCHEMBL20102565 0.88 ALOX5AP (0.33) ALOX5APFEN1SCN9A
SCHEMBL20102614 0.86 HTR2A (0.31) CYP1A2
SCHEMBL20102604 0.86 HTR2A (0.31) CYP1A2
SCHEMBL20111477 0.85 OPRL1 (0.36) CYP1A2OPRL1
SCHEMBL20111312 0.84 HPGD (0.34) SCN9A
SCHEMBL20117630 0.84 HPGD (0.34) SCN9A

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 ALOX5AP 2002/4885FEN1 1547/4885SCN9A 2846/4885
US-10323187-B2 Liquid crystal compound having biphenylene, liquid crystal composition and liquid crystal display device YBX1, PIEZO1, C1S ALOX5AP 2002/4885FEN1 1547/4885SCN9A 2846/4885

“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.