SCHEMBL17356580

SCHEMBL17356580

CCCCCc1c(F)c(F)c(-c2ccc(F)c(F)c2)c(F)c1F

nearest known ligand 0.55

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
GCGR P47871 13/20 0.55
RARB P10826 3/20 0.40
RARA P10276 1/20 0.40
RARG P13631 1/20 0.40
DHODH Q02127 1/20 0.36
ALOX5 P09917 1/20 0.36

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
SCHEMBL17356585 0.89 GCGR (0.45) GCGRRARBRARARARGALOX5
SCHEMBL15128564 0.80 GCGR (0.47) GCGRRARBRARARARG
SCHEMBL1513156 0.77 GCGR (0.42) GCGR
SCHEMBL16258054 0.76 RARB (0.56) GCGRRARBRARARARG
SCHEMBL18416778 0.76 RARB (0.56) GCGRRARBRARARARG
SCHEMBL12762366 0.75 GCGR (0.40) GCGR
SCHEMBL17359269 0.75 DHODH (0.42) GCGRDHODH
SCHEMBL16258039 0.75 RARB (0.66) GCGRRARBRARARARG
SCHEMBL16258015 0.75 RARB (0.66) GCGRRARBRARARARG
SCHEMBL16258029 0.75 RARB (0.66) GCGRRARBRARARARG

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-9527870-B2 Liquid crystal compound, liquid crystal composition and liquid crystal display device JNC CORPORATION (JP) 2016-12-27 US disclosed
US-20150368272-A1 LIQUID CRYSTAL COMPOUND, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE JNC PETROCHEMICAL CORPORATION (JP) 2015-12-24 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-20150368272-A1 LIQUID CRYSTAL COMPOUND, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE YBX3, OCIAD1, PIEZO1 GCGR 2952/4885RARB 4066/4885RARA 3390/4885

“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.