SCHEMBL19804747

SCHEMBL19804747

C=C(C)C(=O)OCCOc1cc(-c2ccc(-c3ccc(C4CCC(C)CC4)cc3)cc2F)ccc1CCCO

nearest known ligand 0.36

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
FFAR4 Q5NUL3 3/20 0.36
CYP3A4 P08684 3/20 0.35
CYP2C9 P11712 2/20 0.35
FASN P49327 1/20 0.35
APP P05067 2/20 0.34
CYP2D6 P10635 1/20 0.33
CYP2C19 P33261 1/20 0.33
ALOX5AP P20292 1/20 0.33
FEN1 P39748 1/20 0.33
CA1 P00915 2/20 0.32
CA2 P00918 2/20 0.32
RARA P10276 3/20 0.31
RARB P10826 3/20 0.31
RARG P13631 3/20 0.31

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
SCHEMBL19624381 0.95 FASN (0.39) FFAR4CYP3A4CYP2C9FASNAPP
SCHEMBL19804739 0.93 CYP3A4 (0.44) FFAR4CYP3A4CYP2C9APPCYP2D6
SCHEMBL19624378 0.90 FASN (0.40) FFAR4CYP3A4CYP2C9FASNAPP
SCHEMBL19797002 0.89 CYP3A4 (0.35) FFAR4CYP3A4CYP2C9APPCYP2D6
SCHEMBL19797020 0.89 CNR2 (0.35) FFAR4CYP3A4CYP2C9APPRARA
SCHEMBL19804691 0.88 CYP3A4 (0.45) FFAR4CYP3A4CYP2C9APPCYP2D6
SCHEMBL19804056 0.88 CYP3A4 (0.43) FFAR4CYP3A4CYP2C9FASNAPP
SCHEMBL19804705 0.86 CYP3A4 (0.39) FFAR4CYP3A4CYP2C9FASNAPP
SCHEMBL19624574 0.86 CYP3A4 (0.39) FFAR4CYP3A4CYP2C9FASNAPP
SCHEMBL19804347 0.85 LTB4R (0.39) ALOX5APFEN1RARARARBRARG

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-20180023001-A1 COMPOUND HAVING POLYMERIZABLE GROUP, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE JNC CORPORATION (JP) 2018-01-25 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-20180023001-A1 COMPOUND HAVING POLYMERIZABLE GROUP, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE SP1, C1S, AP3D1 FFAR4 1715/4885CYP3A4 2192/4885CYP2C9 4202/4885

“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.