SCHEMBL19856153

SCHEMBL19856153

C=C(CO)C(=O)OCCC(CCOC(=O)C(=C)CO)C1CCC(C2CCC(CCCCc3ccc(CCCCC)cc3)CC2)CC1

nearest known ligand 0.37

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ ITGB3 P05106 2/20 0.37
▸ ITGA2B P08514 2/20 0.37
▸ THRB P10828 4/20 0.34
▸ THRA P10827 3/20 0.34
▸ FAAH O00519 1/20 0.34
▸ SPHK1 Q9NYA1 8/20 0.34
▸ SPHK2 Q9NRA0 1/20 0.34
▸ S1PR1 P21453 4/20 0.33
▸ S1PR3 Q99500 3/20 0.33
▸ S1PR4 O95977 2/20 0.33
▸ S1PR5 Q9H228 2/20 0.33
▸ S1PR2 O95136 1/20 0.32
▸ ALDH1A1 P00352 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
SCHEMBL21398436 0.96 THRB (0.36) ITGB3ITGA2BTHRBTHRAFAAH
SCHEMBL21398449 0.89 THRB (0.37) ITGB3ITGA2BTHRBTHRASPHK1
SCHEMBL23635614 0.88 MAPT (0.37) —
SCHEMBL19856183 0.88 THRB (0.35) ITGB3ITGA2BTHRBTHRAFAAH
SCHEMBL21398612 0.87 THRB (0.35) ITGB3ITGA2BTHRBTHRAFAAH
SCHEMBL19854139 0.86 MAPT (0.32) —
SCHEMBL19854147 0.86 TSHR (0.35) —
SCHEMBL21398437 0.85 THRA (0.33) ITGB3ITGA2BTHRBTHRA
SCHEMBL19854634 0.84 SPHK1 (0.32) SPHK1
SCHEMBL19856038 0.84 ITGB3 (0.34) ITGB3ITGA2BTHRBTHRAFAAH

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 3 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-20190292463-A1 POLYMERIZABLE POLAR COMPOUND, LIQUID CRYSTAL COMPOSITION, AND LIQUID CRYSTAL DISPLAY ELEMENT JNC CORPORATION (JP) 2019-09-26 — — US disclosed
WO-2018025974-A1 LIQUID-CRYSTAL DISPLAY ELEMENT AND DISPLAY DEVICE JNC株式会社 2018-02-08 — — WO 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-20190292463-A1 POLYMERIZABLE POLAR COMPOUND, LIQUID CRYSTAL COMPOSITION, AND LIQUID CRYSTAL DISPLAY ELEMENT SP1, PYM1, MPEG1 ITGB3 3617/4885ITGA2B 4545/4885THRB 4130/4885

“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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