SCHEMBL19796450

SCHEMBL19796450

C=CC(=O)OCc1cc(CCC)ccc1-c1ccc(OCC(CO)CO)cc1

nearest known ligand 0.44

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
THRB P10828 3/20 0.44
FFAR1 O14842 9/20 0.39
FFAR4 Q5NUL3 9/20 0.39
ACACB O00763 3/20 0.35
S1PR1 P21453 1/20 0.35
APP P05067 2/20 0.34
PPARA Q07869 1/20 0.34

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
SCHEMBL19796444 0.88 THRB (0.48) THRBFFAR1FFAR4
SCHEMBL19804302 0.85 FFAR1 (0.41) THRBFFAR1FFAR4APP
SCHEMBL19796432 0.85 THRB (0.48) THRBFFAR1FFAR4
SCHEMBL19796440 0.83 THRB (0.49) THRBFFAR1FFAR4
SCHEMBL19796374 0.82 THRB (0.50) THRBFFAR1FFAR4
SCHEMBL19796368 0.80 S1PR1 (0.39) THRBFFAR1FFAR4ACACBS1PR1
SCHEMBL19624624 0.78 FFAR4 (0.40) THRBFFAR1FFAR4APP
SCHEMBL19804585 0.78 FFAR4 (0.45) THRBFFAR1FFAR4APPPPARA
SCHEMBL19796452 0.78 THRB (0.51) THRBFFAR1FFAR4
SCHEMBL19796905 0.77 FFAR4 (0.38) THRBFFAR4PPARA

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-20180023001-A1 COMPOUND HAVING POLYMERIZABLE GROUP, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE JNC CORPORATION (JP) 2018-01-25 US disclosed
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 THRB 4323/4885FFAR1 1057/4885FFAR4 1715/4885

“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.