SCHEMBL19722430

SCHEMBL19722430

C=C(CO)C(=O)OCCOc1c(F)cc(-c2ccc(-c3ccc(C4CCC(CCCCC)CC4)cc3)cc2F)cc1F

nearest known ligand 0.37

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ CYP3A4 P08684 3/20 0.35
▸ CYP2C9 P11712 3/20 0.35
▸ RARB P10826 4/20 0.35
▸ RARA P10276 2/20 0.35
▸ FFAR4 Q5NUL3 6/20 0.35
▸ APP P05067 2/20 0.35
▸ CYP2D6 P10635 1/20 0.35
▸ CYP2C19 P33261 1/20 0.35
▸ P2RY14 Q15391 1/20 0.33
▸ ALDH1A1 P00352 1/20 0.32
▸ LMNA P02545 1/20 0.32
▸ MAPT P10636 1/20 0.32
▸ DGAT1 O75907 1/20 0.31
▸ RARG P13631 1/20 0.31
▸ S1PR1 P21453 1/20 0.31
▸ S1PR3 Q99500 1/20 0.31

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
SCHEMBL19721922 0.93 RARB (0.43) CYP3A4CYP2C9RARBRARAFFAR4
SCHEMBL19722259 0.91 FFAR4 (0.38) CYP3A4CYP2C9RARBRARAFFAR4
SCHEMBL19722224 0.90 RARB (0.40) CYP3A4CYP2C9RARBRARAFFAR4
SCHEMBL19722448 0.89 RARB (0.41) CYP3A4CYP2C9RARBRARAFFAR4
SCHEMBL19722159 0.89 RARB (0.41) CYP3A4CYP2C9RARBRARAFFAR4
SCHEMBL19722403 0.89 S1PR1 (0.39) CYP3A4CYP2C9RARBRARAFFAR4
SCHEMBL19721932 0.89 RARB (0.41) CYP3A4CYP2C9RARBRARAFFAR4
SCHEMBL19721859 0.88 S1PR1 (0.39) CYP2C9RARBRARAFFAR4P2RY14
SCHEMBL19722298 0.88 S1PR1 (0.37) CYP3A4CYP2C9RARBRARAFFAR4
SCHEMBL21322014 0.88 RARB (0.38) CYP3A4CYP2C9RARBRARAFFAR4

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
EP-3257839-B1 POLYMERIZABLE POLAR COMPOUND, LIQUID CRYSTAL COMPOSITION, AND LIQUID CRYSTAL DISPLAY DEVICE JNC CORP (JP) 2019-09-04 — — EP disclosed
US-10392339-B2 Polymerizable polar compound, liquid crystal composition, and liquid crystal display element JNC CORPORATION (JP) 2019-08-27 — — US 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 CYP3A4 2747/4885CYP2C9 4226/4885RARB 2607/4885
US-20170369418-A1 POLYMERIZABLE POLAR COMPOUND, LIQUID CRYSTAL COMPOSITION, AND LIQUID CRYSTAL DISPLAY ELEMENT SP1, SPIN1, SAV1 CYP3A4 3484/4885CYP2C9 4442/4885RARB 1568/4885

“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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