SCHEMBL11939256

SCHEMBL11939256

Oc1ccc(C2=CCC(COc3ccc(-c4ccc(O)c(F)c4F)cc3F)CC2)c(F)c1F

nearest known ligand 0.39

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ FFAR4 Q5NUL3 17/20 0.39
▸ ESR2 Q92731 2/20 0.36
▸ ESR1 P03372 1/20 0.35
▸ 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
SCHEMBL11938846 0.93 ESR2 (0.36) FFAR4ESR2ESR1FEN1
SCHEMBL15381648 0.87 KDM1A (0.36) FFAR4FEN1
SCHEMBL11939326 0.87 ESR2 (0.35) ESR2
SCHEMBL11939399 0.87 ESR2 (0.35) ESR2
SCHEMBL11939810 0.86 ESR2 (0.38) FFAR4ESR2FEN1
SCHEMBL11933343 0.83 FFAR4 (0.36) FFAR4
SCHEMBL11938872 0.83 ESR2 (0.33) ESR2
SCHEMBL11939180 0.83 ESR2 (0.33) ESR2
SCHEMBL15381650 0.82 FFAR4 (0.37) FFAR4ESR1
SCHEMBL11939937 0.82 FFAR4 (0.35) FFAR4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120168677-A1 LIQUID CRYSTAL COMPOUND, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE JNC PETROCHEMICAL CORPORATION (JP) 2012-07-05 — — 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-20120168677-A1 LIQUID CRYSTAL COMPOUND, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE CXCR1, OCIAD1, LEO1 FFAR4 1038/4885ESR2 2410/4885ESR1 2251/4885

“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.

Send feedback