SCHEMBL19796722

SCHEMBL19796722

C=CC(=O)OCCOc1cc(-c2ccc(-c3ccc(CCCCC)cc3)cc2CC)ccc1CO

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
THRB P10828 7/20 0.44
CNR2 P34972 2/20 0.39
CNR1 P21554 1/20 0.39
THRA P10827 6/20 0.38
PTPN1 P18031 1/20 0.38
PTPN6 P29350 1/20 0.38
PTPN11 Q06124 1/20 0.38
RARB P10826 10/20 0.38
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
RARA P10276 2/20 0.37
RARG P13631 1/20 0.37
ALDH1A1 P00352 1/20 0.36
MAPT P10636 1/20 0.36
MTOR P42345 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
SCHEMBL19796731 0.94 THRB (0.43) THRBCNR2CNR1THRAPTPN1
SCHEMBL19796738 0.93 THRB (0.43) THRBCNR2CNR1THRAPTPN1
SCHEMBL19796721 0.91 RARB (0.47) THRBCNR2CNR1THRAPTPN1
SCHEMBL19796751 0.91 THRB (0.44) THRBCNR2CNR1THRAPTPN1
SCHEMBL19796719 0.90 THRB (0.46) THRBTHRARARBMEN1KMT2A
SCHEMBL19796769 0.88 THRB (0.40) THRBCNR2CNR1THRAPTPN1
SCHEMBL19804419 0.88 THRB (0.45) THRBPTPN11RARBMEN1KMT2A
SCHEMBL19796892 0.87 THRB (0.50) THRBTHRAPTPN1PTPN6PTPN11
SCHEMBL19796525 0.87 RARB (0.38) THRBCNR2CNR1THRAPTPN1
SCHEMBL17070539 0.87 THRB (0.44) THRBCNR2CNR1THRAPTPN1

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 THRB 4323/4885CNR2 1075/4885CNR1 320/4885

“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.