SCHEMBL19796380

SCHEMBL19796380

C=CC(=O)OCCCc1cc(CCO)ccc1-c1ccc(CCC)cc1

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
THRB P10828 10/20 0.46
TSHR P16473 3/20 0.43
HPGD P15428 1/20 0.43
ALDH1A1 P00352 1/20 0.36
CYP3A4 P08684 1/20 0.36
CYP4F2 P78329 1/20 0.36
CYP4A11 Q02928 1/20 0.36
THRA P10827 6/20 0.36
RARB P10826 2/20 0.34
ALOX5 P09917 1/20 0.34
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
MET P08581 2/20 0.34
AKR1B10 O60218 1/20 0.34
AKR1B1 P15121 1/20 0.34

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
SCHEMBL19796381 0.94 THRB (0.45) THRBTSHRHPGDALDH1A1CYP3A4
SCHEMBL19796441 0.93 THRB (0.48) THRBTSHRHPGDALDH1A1CYP4F2
SCHEMBL19796379 0.93 THRB (0.48) THRBTSHRHPGDALDH1A1CYP4F2
SCHEMBL19803998 0.90 FFAR4 (0.40) THRBTSHRHPGDALDH1A1CYP3A4
SCHEMBL19796440 0.87 THRB (0.49) THRBTSHRHPGDCYP4F2CYP4A11
SCHEMBL19796436 0.86 THRB (0.47) THRBTSHRHPGDALDH1A1CYP3A4
SCHEMBL19796375 0.85 THRB (0.49) THRBTSHRHPGDALDH1A1THRA
SCHEMBL19796337 0.84 TSHR (0.41) THRBTSHRALDH1A1CYP4F2CYP4A11
SCHEMBL19804247 0.84 FFAR4 (0.39) THRBTSHRHPGDALDH1A1CYP3A4
SCHEMBL19796442 0.83 THRB (0.47) THRBTSHRHPGDALDH1A1CYP4F2

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 4323/4885TSHR 4195/4885HPGD 4741/4885

“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.