SCHEMBL21074610

SCHEMBL21074610

C=C(CO)C(=O)Oc1ccc(C2(c3ccc(OC(=O)C(=C)CO)cc3)CCC(CCc3ccc(-c4ccc(CCCCC)cc4)cc3)CC2)cc1

nearest known ligand 0.42

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ THRB P10828 4/20 0.42
▸ THRA P10827 2/20 0.38
▸ RARB P10826 9/20 0.37
▸ MAPT P10636 2/20 0.36
▸ RARA P10276 2/20 0.36
▸ MEN1 O00255 1/20 0.36
▸ ALDH1A1 P00352 1/20 0.36
▸ MTOR P42345 1/20 0.36
▸ KMT2A Q03164 1/20 0.36
▸ SMN1; SMN2 Q16637 1/20 0.34
▸ FAAH O00519 1/20 0.33
▸ CTSD P07339 1/20 0.33
▸ RARG P13631 1/20 0.33

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
SCHEMBL21074609 0.92 THRB (0.41) THRBTHRAMEN1ALDH1A1KMT2A
SCHEMBL21074636 0.91 THRB (0.34) THRBTHRARARBMAPTRARA
SCHEMBL21074623 0.90 THRB (0.38) THRBTHRAFAAH
SCHEMBL21074651 0.89 THRB (0.42) THRBTHRARARBMAPTRARA
SCHEMBL21074588 0.85 LSS (0.34) THRBMEN1KMT2A
SCHEMBL21074650 0.84 ADORA3 (0.37) MAPTMEN1ALDH1A1KMT2ASMN1; SMN2
SCHEMBL21091631 0.83 THRB (0.34) THRBTHRA
SCHEMBL19722398 0.83 THRB (0.58) THRBTHRARARBMAPTRARA
SCHEMBL19721952 0.83 THRB (0.58) THRBTHRARARBMAPTRARA
SCHEMBL21074598 0.83 SPHK1 (0.41) THRBTHRA

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3495343-A1 POLYMERIZABLE POLAR COMPOUND, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE JNC Corporation (JP) 2019-06-12 — — EP disclosed
US-20190169502-A1 POLYMERIZABLE POLAR COMPOUND, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE JNC CORPORATION (JP) 2019-06-06 — — 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-20190169502-A1 POLYMERIZABLE POLAR COMPOUND, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE PLD1, AP3D1, CCND1 THRB 4725/4885THRA 4737/4885RARB 3445/4885

“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.

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