SCHEMBL19796908

SCHEMBL19796908

C/C=C(\C)C(=O)OCc1cc(-c2ccc(CCCCC)cc2)ccc1-c1ccc(CCCO)cc1

nearest known ligand 0.42

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
RARB P10826 11/20 0.42
RARA P10276 2/20 0.41
RARG P13631 1/20 0.41
ALDH1A1 P00352 2/20 0.41
MEN1 O00255 1/20 0.41
MAPT P10636 1/20 0.41
MTOR P42345 1/20 0.41
KMT2A Q03164 1/20 0.41
THRB P10828 3/20 0.37
THRA P10827 2/20 0.37
GPR84 Q9NQS5 1/20 0.37
S1PR1 P21453 1/20 0.36
ABCB1 P08183 1/20 0.36

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
SCHEMBL19796930 0.94 RARB (0.42) RARBRARARARGALDH1A1MEN1
SCHEMBL19804258 0.90 FFAR4 (0.40)
SCHEMBL19796453 0.89 CYP4A11 (0.37) RARB
SCHEMBL19796873 0.88 THRB (0.43) RARBRARARARGALDH1A1MEN1
SCHEMBL19796918 0.88 THRB (0.43) RARBRARARARGALDH1A1MEN1
SCHEMBL19804352 0.86 FFAR4 (0.41) RARBMEN1KMT2A
SCHEMBL19796773 0.85 RARB (0.38) RARBRARARARGALDH1A1MEN1
SCHEMBL19796911 0.85 RARB (0.42) RARBRARARARGALDH1A1MEN1
SCHEMBL19796896 0.84 THRB (0.51) RARBRARARARGALDH1A1MEN1
SCHEMBL19796867 0.84 THRB (0.43) RARBRARARARGALDH1A1MEN1

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 RARB 3517/4885RARA 3585/4885RARG 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.