SCHEMBL19796744

SCHEMBL19796744

C=CC(=O)OCCc1cc(-c2ccc(-c3ccc(CCCCC)cc3)cc2F)ccc1OCCO

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RARB P10826 4/20 0.46
RARA P10276 1/20 0.44
RARG P13631 1/20 0.44
THRB P10828 5/20 0.42
CNR2 P34972 2/20 0.41
CNR1 P21554 1/20 0.41
PPARD Q03181 2/20 0.40
S1PR1 P21453 2/20 0.39
PTPN11 Q06124 2/20 0.39
PTPN1 P18031 1/20 0.39
PTPN6 P29350 1/20 0.39
THRA P10827 4/20 0.36
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
USP2 O75604 1/20 0.36
ALDH1A1 P00352 1/20 0.36
LMNA P02545 1/20 0.36
CYP3A4 P08684 1/20 0.36
MAPK1 P28482 1/20 0.36
CASP1 P29466 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
SCHEMBL19796749 0.97 RARB (0.47) RARBRARARARGTHRBCNR2
SCHEMBL19796752 0.92 THRB (0.44) RARBRARARARGTHRBCNR2
SCHEMBL17070539 0.92 THRB (0.44) RARBRARARARGTHRBCNR2
SCHEMBL19796763 0.91 THRB (0.48) RARBRARARARGTHRBCNR2
SCHEMBL19796730 0.88 RARB (0.46) RARBRARARARGTHRBCNR2
SCHEMBL19796624 0.88 RARB (0.46) RARBRARARARGTHRBCNR2
SCHEMBL19796721 0.87 RARB (0.47) RARBRARARARGTHRBCNR2
SCHEMBL19624431 0.86 RARB (0.48) RARBRARARARGTHRBS1PR1
SCHEMBL19804546 0.86 ALOX5AP (0.43) RARBRARARARGTHRBPPARD
SCHEMBL19796840 0.86 THRB (0.47) RARBRARARARGTHRBS1PR1

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.