SCHEMBL17016899

SCHEMBL17016899

CCOc1ccc(-c2ccc(C3CCC(/C=C(\F)CCCF)CO3)cc2)c(F)c1F

nearest known ligand 0.33

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ ESR1 P03372 1/20 0.33
▸ FPR2 P25090 3/20 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
SCHEMBL13579371 0.80 FPR2 (0.34) FPR2
SCHEMBL13579521 0.80 FPR2 (0.34) FPR2
SCHEMBL13579523 0.79 FPR2 (0.33) FPR2
SCHEMBL13579372 0.79 FPR2 (0.33) FPR2
SCHEMBL17016754 0.76 FPR2 (0.34) ESR1FPR2
SCHEMBL13580057 0.76 FPR2 (0.32) FPR2
SCHEMBL9899628 0.76 KDM1A (0.38) FPR2
SCHEMBL13579467 0.76 FPR2 (0.33) FPR2
SCHEMBL13579346 0.76 FPR2 (0.33) FPR2
SCHEMBL13580085 0.76 FPR2 (0.31) FPR2

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-9404040-B2 Liquid crystal compound having fluorine-containing alkenyl terminal group, liquid crystal composition and liquid crystal display device JNC CORPORATION (JP) 2016-08-02 — — US disclosed
US-20150232759-A1 Liquid crystal compound having fluorine-containing alkenyl terminal group, liquid crystal composition and liquid crystal display device JNC CORPORATION (JP) 2015-08-20 — — 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-20150232759-A1 Liquid crystal compound having fluorine-containing alkenyl terminal group, liquid crystal composition and liquid crystal display device PYM1, CXCR1, LEO1 ESR1 3452/4885FPR2 258/4885

“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.

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