SCHEMBL3269907

SCHEMBL3269907

CCCCC[C@H]1CC[C@H](c2ccc(OC[C@H]3CC[C@H]([C@H]4CC[C@H](CCC)CC4)CC3)c(F)c2F)CC1

nearest known ligand 0.34

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 12/20 0.34
CNR1 P21554 4/20 0.34
HTR2A P28223 2/20 0.33
HTR2C P28335 2/20 0.33
HTR2B P41595 2/20 0.33
GAA P10253 1/20 0.32
MAPT P10636 1/20 0.32
RIPK1 Q13546 1/20 0.32
SCN9A Q15858 2/20 0.32
ALOX5AP P20292 1/20 0.32
FEN1 P39748 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
SCHEMBL12444491 1.00 CNR2 (0.34) CNR2CNR1HTR2AHTR2CHTR2B
SCHEMBL3268569 1.00 CNR2 (0.34) CNR2CNR1HTR2AHTR2CHTR2B
SCHEMBL12994101 1.00 CNR2 (0.34) CNR2CNR1HTR2AHTR2CHTR2B
SCHEMBL12994088 1.00 CNR2 (0.34) CNR2CNR1HTR2AHTR2CHTR2B
SCHEMBL15316550 1.00 CNR2 (0.34) CNR2CNR1HTR2AHTR2CHTR2B
SCHEMBL3272261 1.00 CNR2 (0.34) CNR2CNR1HTR2AHTR2CHTR2B
SCHEMBL21787346 0.94 CNR2 (0.36) CNR2CNR1HTR2AHTR2CHTR2B
SCHEMBL3270265 0.92 CNR2 (0.32) CNR2CNR1HTR2AHTR2CHTR2B
SCHEMBL12994100 0.92 CNR2 (0.32) CNR2CNR1HTR2AHTR2CHTR2B
SCHEMBL12733583 0.92 CNR2 (0.35) CNR2CNR1HTR2AHTR2CHTR2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2199270-B1 LIQUID CRYSTALLINE COMPOUND, LIQUID CRYSTAL COMPOSITION, AND LIQUID CRYSTAL DISPLAY DEVICE JNC CORP (JP) 2016-05-25 EP disclosed
US-8580142-B2 Liquid crystal compound, liquid crystal composition and liquid crystal display device JNC CORPORATION (JP) 2013-11-12 US disclosed
US-20100328600-A1 LIQUID CRYSTAL COMPOUND, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE CHISSO CORPORATION (JP) 2010-12-30 US disclosed
EP-2199270-A1 LIQUID CRYSTALLINE COMPOUND, LIQUID CRYSTAL COMPOSITION, AND LIQUID CRYSTAL DISPLAY ELEMENT Chisso Corporation (JP) 2010-06-23 EP 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-20100328600-A1 LIQUID CRYSTAL COMPOUND, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE KIF23, MARK3, CCND3 CNR2 1726/4885CNR1 2381/4885HTR2A 2123/4885

“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.