SCHEMBL9925032

SCHEMBL9925032

CCCc1ccc(C2CCC3CC(COC4CCC(COc5ccc(OCC)c(F)c5F)CC4)CCC3C2)cc1

nearest known ligand 0.34

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
SCN9A Q15858 4/20 0.34
GPR119 Q8TDV5 3/20 0.32
KDM1A O60341 2/20 0.32
ACACB O00763 3/20 0.31
FFAR4 Q5NUL3 1/20 0.31
SPHK1 Q9NYA1 1/20 0.30
SLC6A3 Q01959 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
SCHEMBL9924950 0.96 SCN9A (0.35) SCN9AGPR119KDM1ASPHK1SLC6A3
SCHEMBL9924949 0.94 SCN9A (0.34) SCN9AGPR119KDM1ASPHK1SLC6A3
SCHEMBL9924782 0.94 SCN9A (0.35) SCN9AKDM1AFFAR4SPHK1SLC6A3
SCHEMBL9924962 0.93 SCN9A (0.35) SCN9AKDM1AFFAR4SPHK1SLC6A3
SCHEMBL9924918 0.91 SCN9A (0.34) SCN9AKDM1AFFAR4SPHK1SLC6A3
SCHEMBL9925029 0.90 KDM1A (0.33) SCN9AKDM1AFFAR4SPHK1SLC6A3
SCHEMBL9925128 0.90 SCN9A (0.33) SCN9AKDM1AACACBFFAR4SPHK1
SCHEMBL9924896 0.89 SCN9A (0.37) SCN9AKDM1ASPHK1SLC6A3
SCHEMBL9924967 0.87 SENP8 (0.34) SCN9AKDM1AACACBFFAR4
SCHEMBL9924966 0.87 SENP8 (0.34) SCN9AKDM1AACACBFFAR4

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2468707-B1 DECAHYDRONAPHTHALENE COMPOUNDS, LIQUID CRYSTAL COMPOSITIONS CONTAINING THE COMPOUNDS, AND LIQUID CRYSTAL DISPLAY DEVICES CONTAINING THE LIQUID CRYSTAL COMPOSITIONS JNC CORP (JP) 2017-08-02 EP disclosed
US-8465674-B2 Decahydronaphthalene compound, liquid crystal composition including the compound and liquid crystal display device containing the liquid crystal composition JNC CORPORATION (JP) 2013-06-18 US disclosed
US-8465674-B2 Decahydronaphthalene compound, liquid crystal composition including the compound and liquid crystal display device containing the liquid crystal composition JNC CORPORATION (JP) 2013-06-18 US disclosed
EP-2468707-A1 DECAHYDRONAPHTHALENE COMPOUNDS, LIQUID CRYSTAL COMPOSITIONS CONTAINING THE COMPOUNDS, AND LIQUID CRYSTAL DISPLAY ELEMENTS CONTAINING THE LIQUID CRYSTAL COMPOSITIONS JNC Corporation (JP) 2012-06-27 EP disclosed
US-20120145959-A1 DECAHYDRONAPHTHALENE COMPOUND, LIQUID CRYSTAL COMPOSITION INCLUDING THE COMPOUND AND LIQUID CRYSTAL DISPLAY DEVICE CONTAINING THE LIQUID CRYSTAL COMPOSITION JNC PETROCHEMICAL CORPORATION (JP) 2012-06-14 US disclosed
US-20120145959-A1 DECAHYDRONAPHTHALENE COMPOUND, LIQUID CRYSTAL COMPOSITION INCLUDING THE COMPOUND AND LIQUID CRYSTAL DISPLAY DEVICE CONTAINING THE LIQUID CRYSTAL COMPOSITION JNC PETROCHEMICAL CORPORATION (JP) 2012-06-14 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-20120145959-A1 DECAHYDRONAPHTHALENE COMPOUND, LIQUID CRYSTAL COMPOSITION INCLUDING THE COMPOUND AND LIQUID CRYSTAL DISPLAY DEVICE CONTAINING THE LIQUID CRYSTAL COMPOSITION DCUN1D2, OCIAD1, CPNE4 SCN9A 3847/4885GPR119 4622/4885KDM1A 1725/4885

“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.