SCHEMBL19804701

SCHEMBL19804701

C=C(C)C(=O)OCCc1ccccc1CCc1ccc(-c2ccc(CCCO)cc2)c(CC)c1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP4A11 Q02928 2/20 0.37
CYP4F2 P78329 1/20 0.37
FFAR1 O14842 3/20 0.34
FFAR4 Q5NUL3 3/20 0.34
NR1H2 P55055 1/20 0.34
CA1 P00915 1/20 0.34
CA2 P00918 1/20 0.34
PPARA Q07869 1/20 0.33
THRB P10828 1/20 0.33
LPAR1 Q92633 3/20 0.33
MMP2 P08253 2/20 0.33
MMP3 P08254 1/20 0.33
SCN1A P35498 1/20 0.33
SCN2A Q99250 1/20 0.33
SCN3A Q9NY46 1/20 0.33
EP300 Q09472 1/20 0.33
KAT5 Q92993 1/20 0.33
KAT8 Q9H7Z6 1/20 0.33
TSHR P16473 2/20 0.33
RARB P10826 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
SCHEMBL19796956 0.91 RARB (0.39) CYP4A11CYP4F2THRBEP300KAT5
SCHEMBL19796423 0.87 TSHR (0.38) CYP4A11CYP4F2PPARATHRBTSHR
SCHEMBL19804348 0.87 FFAR1 (0.36) CYP4A11CYP4F2FFAR1FFAR4PPARA
SCHEMBL17070466 0.87 TSHR (0.38) CYP4A11CYP4F2CA1CA2PPARA
SCHEMBL17484455 0.86 TSHR (0.40) CYP4A11CYP4F2CA1CA2PPARA
SCHEMBL17070449 0.86 TSHR (0.35) CYP4A11CYP4F2PPARATHRBTSHR
SCHEMBL19796429 0.85 THRA (0.45) THRBTSHRRARB
SCHEMBL19796238 0.85 ALOX5 (0.36) CYP4A11CYP4F2CA1CA2THRB
SCHEMBL19796581 0.84 TSHR (0.38) CYP4A11CYP4F2PPARATHRBTSHR
SCHEMBL19804559 0.84 MGLL (0.37) CYP4A11FFAR1FFAR4NR1H2CA1

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 CYP4A11 1991/4885CYP4F2 2577/4885FFAR1 1057/4885

“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.