SCHEMBL19804499

SCHEMBL19804499

C=CC(=O)OCCOc1cc(-c2ccc(C3CCCCC3)cc2)ccc1CCCO

nearest known ligand 0.39

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
FFAR4 Q5NUL3 2/20 0.39
THRB P10828 1/20 0.37
SLC6A9 P48067 3/20 0.35
PTGDR2 Q9Y5Y4 2/20 0.34
PTGDR Q13258 1/20 0.34
CYP3A4 P08684 2/20 0.34
CYP2C9 P11712 1/20 0.34
PPARG P37231 2/20 0.33
PPARA Q07869 1/20 0.33
TSHR P16473 1/20 0.33
APP P05067 1/20 0.32
ALDH1A1 P00352 1/20 0.32
HPGD P15428 1/20 0.32
KCNH2 Q12809 1/20 0.32
HRH3 Q9Y5N1 1/20 0.32
MCHR1 Q99705 2/20 0.32
S1PR1 P21453 1/20 0.32
S1PR3 Q99500 1/20 0.32
S1PR5 Q9H228 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
SCHEMBL19804488 0.94 THRB (0.38) FFAR4THRBSLC6A9PTGDR2PTGDR
SCHEMBL19804726 0.92 FFAR4 (0.41) FFAR4THRBSLC6A9CYP3A4CYP2C9
SCHEMBL19804444 0.91 THRB (0.39) FFAR4THRBSLC6A9PTGDR2PTGDR
SCHEMBL19804813 0.88 FFAR4 (0.45) FFAR4THRBSLC6A9PTGDR2PTGDR
SCHEMBL19804595 0.88 FFAR4 (0.38) FFAR4THRBPTGDR2PTGDRCYP3A4
SCHEMBL19804543 0.88 FFAR4 (0.38) FFAR4THRBPTGDR2PTGDRCYP3A4
SCHEMBL19803227 0.87 KCNH2 (0.36) THRBKCNH2HRH3
SCHEMBL19804541 0.87 FFAR4 (0.37) FFAR4THRBSLC6A9CYP3A4CYP2C9
SCHEMBL19804355 0.86 FFAR4 (0.38) FFAR4SLC6A9PTGDR2PTGDRCYP3A4
SCHEMBL19804752 0.86 CYP3A4 (0.44) FFAR4THRBSLC6A9PTGDR2PTGDR

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 1715/4885THRB 4323/4885SLC6A9 2938/4885

“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.