SCHEMBL19796300

SCHEMBL19796300

C=CC(=O)OCCOc1cc(CCc2ccc(CCC)cc2)ccc1CCCO

nearest known ligand 0.46

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
THRB P10828 6/20 0.46
THRA P10827 2/20 0.40
TSHR P16473 2/20 0.40
HPGD P15428 1/20 0.40
LTB4R Q15722 1/20 0.38
CNR2 P34972 8/20 0.38
CNR1 P21554 5/20 0.38

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
SCHEMBL19796391 0.97 THRB (0.45) THRBTHRATSHRHPGDLTB4R
SCHEMBL19804187 0.91 THRB (0.40) THRBTHRATSHRHPGDCNR2
SCHEMBL19804231 0.88 THRB (0.40) THRBTSHRHPGD
SCHEMBL19796291 0.85 RARB (0.37) THRBTHRATSHRHPGDLTB4R
SCHEMBL19796279 0.84 LTB4R (0.40) THRBTSHRLTB4RCNR2CNR1
SCHEMBL19796383 0.84 THRB (0.41) THRBTHRATSHRHPGDLTB4R
SCHEMBL19796385 0.83 THRB (0.43) THRBTHRATSHRHPGDLTB4R
SCHEMBL19796442 0.81 THRB (0.47) THRBTHRATSHRHPGDLTB4R
SCHEMBL19796290 0.80 THRB (0.46) THRBTHRATSHRHPGD
SCHEMBL19796738 0.80 THRB (0.43) THRBTHRACNR2CNR1

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 4323/4885THRA 4376/4885TSHR 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.