SCHEMBL19804252

SCHEMBL19804252

C=CC(=O)OCc1cc(-c2ccccc2)ccc1-c1ccc(CO)cc1CC

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGER4 P35408 1/20 0.35
HSD17B1 P14061 1/20 0.35
THRB P10828 1/20 0.35
EGFR P00533 2/20 0.35
FFAR1 O14842 3/20 0.35
FFAR4 Q5NUL3 3/20 0.35
BCL2 P10415 1/20 0.34
NPC1 O15118 1/20 0.34
RAB9A P51151 1/20 0.34
GSTP1 P09211 1/20 0.34
PTGS1 P23219 1/20 0.34
BAZ2B Q9UIF8 1/20 0.34
BAZ2A Q9UIF9 1/20 0.34
PDE1A P54750 1/20 0.34
PDE1B Q01064 1/20 0.34
PDE1C Q14123 1/20 0.34
ACMSD Q8TDX5 1/20 0.33
PDK2 Q15119 1/20 0.33
GSTO1 P78417 1/20 0.33
S1PR1 P21453 1/20 0.33

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
SCHEMBL19804794 0.94 PDE1A (0.38) PTGER4THRBEGFRFFAR1FFAR4
SCHEMBL19804679 0.91 FFAR1 (0.41) PTGER4THRBEGFRFFAR1FFAR4
SCHEMBL19804484 0.89 CYP4F2 (0.37) THRBEGFRFFAR1FFAR4S1PR1
SCHEMBL19804636 0.88 FFAR1 (0.39) THRBFFAR1FFAR4NPC1RAB9A
SCHEMBL19796889 0.87 THRB (0.48) THRB
SCHEMBL19804663 0.83 FFAR1 (0.41) PTGER4FFAR1FFAR4PTGS1PDK2
SCHEMBL19804587 0.83 THRB (0.42) THRBFFAR1FFAR4PDE1APDE1B
SCHEMBL19804672 0.83 FFAR1 (0.43) PTGER4THRBFFAR1FFAR4NPC1
SCHEMBL19624542 0.82 FFAR4 (0.43) PTGER4THRBFFAR1FFAR4S1PR1
SCHEMBL19797096 0.82 THRB (0.49) THRB

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 PTGER4 2215/4885HSD17B1 1285/4885THRB 4323/4885

“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.