SCHEMBL19722058

SCHEMBL19722058

C=C(CO)C(=O)OCCc1ccc(OC(=O)C2CCC(C3CCC(CCCCC)CC3)CC2)cc1

nearest known ligand 0.45

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ F2 P00734 1/20 0.41
▸ THRB P10828 3/20 0.37
▸ THRA P10827 1/20 0.36
▸ GAA P10253 1/20 0.35
▸ MAPT P10636 1/20 0.35
▸ ITGB3 P05106 5/20 0.34
▸ ITGA2B P08514 5/20 0.34
▸ KMT2A Q03164 2/20 0.33
▸ HTT P42858 1/20 0.33
▸ SMN1; SMN2 Q16637 1/20 0.33
▸ TDP1 Q9NUW8 1/20 0.33
▸ PLG P00747 1/20 0.33
▸ S1PR5 Q9H228 1/20 0.32
▸ ELANE P08246 1/20 0.32
▸ ITGAV P06756 1/20 0.32
▸ CHRM2 P08172 1/20 0.32
▸ SLC6A4 P31645 1/20 0.32

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
SCHEMBL19722362 0.93 F2 (0.43) F2THRBTHRAGAAMAPT
SCHEMBL19755067 0.85 SPHK1 (0.40) MAPT
SCHEMBL21398193 0.84 F2 (0.32) F2GAAMAPTKMT2AHTT
SCHEMBL21322012 0.84 F2 (0.47) F2THRBTHRAGAAMAPT
SCHEMBL19755082 0.84 THRB (0.43) F2THRBTHRAITGB3ITGA2B
SCHEMBL17809772 0.84 F2 (0.51) F2THRBTHRAGAAMAPT
SCHEMBL19721965 0.84 PKM (0.38) GAAMAPTKMT2AHTT
SCHEMBL11412043 0.84 F2 (0.51) F2THRBTHRAGAAMAPT
SCHEMBL11405959 0.84 F2 (0.51) F2THRBTHRAGAAMAPT
SCHEMBL11412150 0.84 F2 (0.51) F2THRBTHRAGAAMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210214615-A1 LIQUID CRYSTAL DISPLAY DEVICE AND DISPLAY UNIT JNC CORPORATION (JP) 2021-07-15 — — US disclosed
US-10392339-B2 Polymerizable polar compound, liquid crystal composition, and liquid crystal display element JNC CORPORATION (JP) 2019-08-27 — — US disclosed
WO-2018025974-A1 LIQUID-CRYSTAL DISPLAY ELEMENT AND DISPLAY DEVICE JNC株式会社 2018-02-08 — — WO disclosed
US-20170369418-A1 POLYMERIZABLE POLAR COMPOUND, LIQUID CRYSTAL COMPOSITION, AND LIQUID CRYSTAL DISPLAY ELEMENT JNC CORPORATION (JP) 2017-12-28 — — US disclosed
EP-3257839-A1 POLYMERIZABLE POLAR COMPOUND, LIQUID CRYSTAL COMPOSITION, AND LIQUID CRYSTAL DISPLAY ELEMENT JNC Corporation (JP) 2017-12-20 — — EP 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 (2 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-10392339-B2 Polymerizable polar compound, liquid crystal composition, and liquid crystal display element SP1, HVCN1, CXCR1 F2 779/4885THRB 4606/4885THRA 4306/4885
US-20170369418-A1 POLYMERIZABLE POLAR COMPOUND, LIQUID CRYSTAL COMPOSITION, AND LIQUID CRYSTAL DISPLAY ELEMENT SP1, SPIN1, SAV1 F2 787/4885THRB 4233/4885THRA 3611/4885

“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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