SCHEMBL19804152

SCHEMBL19804152

C=CC(=O)OCCOc1cc(-c2ccc(-c3ccccc3)cc2CC)ccc1CCCO

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
THRB P10828 2/20 0.43
RARB P10826 7/20 0.41
RARG P13631 7/20 0.41
RARA P10276 6/20 0.41
LTB4R Q15722 6/20 0.39
LTB4R2 Q9NPC1 6/20 0.39
THRA P10827 1/20 0.38
EGFR P00533 1/20 0.37
SLC6A9 P48067 1/20 0.36
PTPN11 Q06124 1/20 0.36
PDE4A P27815 1/20 0.35
PDE4B Q07343 1/20 0.35
PDE4C Q08493 1/20 0.35
PDE4D Q08499 1/20 0.35

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
SCHEMBL19804108 0.94 THRB (0.44) THRBRARBRARGRARALTB4R
SCHEMBL19804419 0.91 THRB (0.45) THRBRARBRARGRARALTB4R
SCHEMBL19804489 0.89 THRB (0.45) THRBRARBRARGRARAEGFR
SCHEMBL19796738 0.89 THRB (0.43) THRBRARBRARGRARATHRA
SCHEMBL19804494 0.86 RARB (0.41) RARBRARGRARALTB4RLTB4R2
SCHEMBL19804144 0.86 RARA (0.37) THRBRARBRARGRARATHRA
SCHEMBL19558416 0.85 RARA (0.44) THRBRARBRARGRARALTB4R
SCHEMBL19804726 0.84 FFAR4 (0.41) THRBRARBRARGRARALTB4R
SCHEMBL19796731 0.84 THRB (0.43) THRBRARBRARGRARATHRA
SCHEMBL19804527 0.83 THRB (0.41) THRBRARBRARGRARAEGFR

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 THRB 4323/4885RARB 3517/4885RARG 3736/4885

“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.