SCHEMBL19796765

SCHEMBL19796765

C=CC(=O)OCCOc1cc(-c2ccc(-c3ccc(CCCCC)cc3)cc2F)ccc1CCCN

nearest known ligand 0.43

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
RARB P10826 5/20 0.43
RARA P10276 2/20 0.43
RARG P13631 1/20 0.43
THRB P10828 6/20 0.41
THRA P10827 5/20 0.39
S1PR1 P21453 4/20 0.37
PTPN1 P18031 1/20 0.36
PTPN6 P29350 1/20 0.36
PTPN11 Q06124 1/20 0.36
S1PR3 Q99500 2/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
PDE4A P27815 1/20 0.35
PDE4B Q07343 1/20 0.35
PDE4C Q08493 1/20 0.35
PDE4D Q08499 1/20 0.35
CNR2 P34972 2/20 0.35
CNR1 P21554 1/20 0.35
PPARD Q03181 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
SCHEMBL19796730 0.92 RARB (0.46) RARBRARARARGTHRBTHRA
SCHEMBL19796721 0.91 RARB (0.47) RARBRARARARGTHRBTHRA
SCHEMBL19804605 0.87 THRB (0.43) THRBTHRAPDE4APDE4BPDE4C
SCHEMBL19796738 0.84 THRB (0.43) RARBRARARARGTHRBTHRA
SCHEMBL19796744 0.83 RARB (0.46) RARBRARARARGTHRBTHRA
SCHEMBL19796731 0.83 THRB (0.43) RARBRARARARGTHRBTHRA
SCHEMBL19796720 0.83 RARB (0.48) RARBRARARARGTHRBTHRA
SCHEMBL19796737 0.82 RARB (0.47) RARBRARARARGTHRBTHRA
SCHEMBL19796291 0.82 RARB (0.37) RARBTHRBTHRAS1PR1S1PR3
SCHEMBL19796722 0.82 THRB (0.44) RARBRARARARGTHRBTHRA

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.