SCHEMBL19796340

SCHEMBL19796340

C=C(C)C(=O)OCCc1cc(CCCO)ccc1-c1ccc(CCC)cc1F

nearest known ligand 0.36

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
RARB P10826 1/20 0.36
TSHR P16473 2/20 0.36
CYP4A11 Q02928 2/20 0.35
CYP4F2 P78329 1/20 0.35
THRB P10828 2/20 0.34
POLB P06746 1/20 0.32
APEX1 P27695 1/20 0.32
HTT P42858 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
THRA P10827 1/20 0.32
S1PR1 P21453 1/20 0.32
CETP P11597 1/20 0.31
CA1 P00915 2/20 0.31
CA2 P00918 2/20 0.31
KDM1A O60341 1/20 0.30

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
SCHEMBL19796333 0.94 THRB (0.35) RARBTSHRCYP4A11CYP4F2THRB
SCHEMBL19796326 0.92 CYP4F2 (0.36) RARBTSHRCYP4A11CYP4F2THRB
SCHEMBL19804216 0.90 CA1 (0.36) RARBTSHRCYP4A11CYP4F2THRB
SCHEMBL19796413 0.90 TSHR (0.39) RARBTSHRCYP4A11CYP4F2THRB
SCHEMBL19796351 0.88 CYP4A11 (0.38) RARBTSHRCYP4A11CYP4F2THRB
SCHEMBL19796423 0.88 TSHR (0.38) RARBTSHRCYP4A11CYP4F2THRB
SCHEMBL17484454 0.88 RARB (0.36) RARBTSHRCYP4A11CYP4F2THRB
SCHEMBL19796354 0.87 POLB (0.37) RARBTHRBPOLBAPEX1HTT
SCHEMBL19796352 0.87 RARB (0.36) RARBTSHRCYP4A11CYP4F2THRB
SCHEMBL19796250 0.86 RARB (0.39) RARBTSHRTHRBS1PR1

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 RARB 3517/4885TSHR 4195/4885CYP4A11 1991/4885

“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.