SCHEMBL19854707

SCHEMBL19854707

C=C(CO)C(=O)OCCOc1cc(OCCOC(=O)C(=C)CO)cc(-c2ccc(-c3ccc(CCC4CCC(CCCCC)CC4)c(F)c3)c(F)c2)c1

nearest known ligand 0.38

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ RARB P10826 3/20 0.38
▸ RARA P10276 1/20 0.38
▸ CNR2 P34972 7/20 0.35
▸ S1PR1 P21453 2/20 0.35
▸ S1PR3 Q99500 2/20 0.35
▸ FFAR1 O14842 2/20 0.34
▸ MCL1 Q07820 1/20 0.33
▸ CNR1 P21554 4/20 0.33
▸ PPARD Q03181 1/20 0.33
▸ PTPN11 Q06124 1/20 0.33
▸ NR4A2 P43354 1/20 0.32
▸ DHODH Q02127 1/20 0.32
▸ HTR2A P28223 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
SCHEMBL20313638 0.95 RARB (0.42) RARBRARACNR2S1PR1FFAR1
SCHEMBL20322689 0.94 RARA (0.34) RARBRARACNR2S1PR1S1PR3
SCHEMBL19854708 0.92 RARB (0.37) RARBRARACNR2FFAR1CNR1
SCHEMBL20407542 0.91 RARB (0.39) RARBRARACNR2FFAR1CNR1
SCHEMBL20322644 0.89 RARB (0.38) RARBRARACNR2S1PR1FFAR1
SCHEMBL19854706 0.89 RARB (0.38) RARBRARACNR2FFAR1CNR1
SCHEMBL20322695 0.87 RARB (0.33) RARBRARACNR2FFAR1HTR2A
SCHEMBL20407557 0.87 CNR2 (0.35) RARBRARACNR2S1PR1S1PR3
SCHEMBL19722403 0.85 S1PR1 (0.39) RARBRARACNR2S1PR1S1PR3
SCHEMBL19721922 0.85 RARB (0.43) RARBRARAS1PR1S1PR3PTPN11

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-3351525-A1 POLYMERIZABLE POLAR COMPOUND, LIQUID CRYSTAL COMPOSITION, AND LIQUID CRYSTAL DISPLAY ELEMENT JNC Corporation (JP) 2018-07-25 — — EP disclosed
US-20180179443-A1 POLYMERIZABLE POLAR COMPOUND, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE JNC CORPORATION (JP) 2018-06-28 — — US disclosed
US-20180179443-A1 POLYMERIZABLE POLAR COMPOUND, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE JNC CORPORATION (JP) 2018-06-28 — — 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-20180179443-A1 POLYMERIZABLE POLAR COMPOUND, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE C1S, CCND1, C5 RARB 3791/4885RARA 3471/4885CNR2 668/4885

“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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