SCHEMBL19796963

SCHEMBL19796963

C=CC(=O)OCCc1cc(CCCCC)ccc1CCc1ccc(-c2ccc(CCCO)cc2)c(F)c1

nearest known ligand 0.48

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
RARB P10826 6/20 0.48
THRB P10828 9/20 0.43
RARA P10276 1/20 0.39
RARG P13631 1/20 0.39
THRA P10827 7/20 0.38
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
S1PR1 P21453 3/20 0.35
HPGD P15428 1/20 0.35
TSHR P16473 1/20 0.35
S1PR3 Q99500 2/20 0.35

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
SCHEMBL19796838 0.91 RARB (0.49) RARBTHRBRARARARGTHRA
SCHEMBL19796846 0.90 THRB (0.47) RARBTHRBRARARARGTHRA
SCHEMBL19624431 0.90 RARB (0.48) RARBTHRBRARARARGTHRA
SCHEMBL19801665 0.89 RARB (0.38) RARBTHRBMEN1KMT2AS1PR1
SCHEMBL19796895 0.87 RARB (0.49) RARBTHRBRARARARGTHRA
SCHEMBL19796737 0.86 RARB (0.47) RARBTHRBRARARARGTHRA
SCHEMBL19796736 0.85 THRB (0.42) RARBTHRBRARARARGTHRA
SCHEMBL19796967 0.85 RARB (0.48) RARBTHRBRARARARGTHRA
SCHEMBL19796965 0.85 THRB (0.46) RARBTHRBRARARARGTHRA
SCHEMBL19796960 0.84 RARB (0.50) RARBTHRBRARARARGTHRA

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 3517/4885THRB 4323/4885RARA 3585/4885

“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.