SCHEMBL19796451

SCHEMBL19796451

C=CC(=O)OCCOc1cc(CCC)ccc1C1CCC(CCCO)CC1

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
THRB P10828 5/20 0.39
PPARG P37231 3/20 0.36
TSHR P16473 2/20 0.35
HPGD P15428 1/20 0.35
CNR2 P34972 4/20 0.32
SCN9A Q15858 1/20 0.32
TRPV1 Q8NER1 1/20 0.32
NPC1 O15118 1/20 0.32
ALDH1A1 P00352 1/20 0.32
POLB P06746 1/20 0.32
RAB9A P51151 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
PTGES O14684 1/20 0.32
ALOX5 P09917 1/20 0.32
CYP4F2 P78329 1/20 0.31
CYP4A11 Q02928 1/20 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
SCHEMBL19804217 0.88 THRB (0.38) THRBPPARGTSHRHPGDCNR2
SCHEMBL19796903 0.88 HPGD (0.36) THRBPPARGTSHRHPGDCNR2
SCHEMBL19804588 0.83 PPARG (0.38) THRBPPARGHPGD
SCHEMBL19796839 0.81 SPHK1 (0.37) THRBPPARGTSHRHPGDALDH1A1
SCHEMBL19796835 0.80 SPHK1 (0.36) THRBPPARGTSHRHPGDALDH1A1
SCHEMBL19796399 0.80 SCN9A (0.38) THRBPPARGTSHRHPGDCNR2
SCHEMBL19796401 0.79 TSHR (0.39) THRBPPARGTSHRHPGDCNR2
SCHEMBL19797130 0.78 RARB (0.36) THRBTSHRHPGDALDH1A1SMN1; SMN2
SCHEMBL19796855 0.77 SCN9A (0.36) THRBPPARGTSHRHPGDCNR2
SCHEMBL19796300 0.77 THRB (0.46) THRBTSHRHPGDCNR2

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 4323/4885PPARG 3314/4885TSHR 4195/4885

“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.