SCHEMBL19722380

SCHEMBL19722380

C=C(CO)C(=O)OCCOc1ccc(C2CCC(C3CCC(C4CCC(CCCCC)CC4)CC3)CC2)c(CC)c1

nearest known ligand 0.36

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ CNR2 P34972 8/20 0.36
▸ CNR1 P21554 5/20 0.35
▸ ITGB3 P05106 2/20 0.34
▸ ITGA2B P08514 2/20 0.34
▸ PTGES O14684 1/20 0.33
▸ ALOX5 P09917 1/20 0.33
▸ LNPEP Q9UIQ6 2/20 0.33
▸ MTNR1A P48039 1/20 0.33
▸ MTNR1B P49286 1/20 0.33
▸ RAB9A P51151 1/20 0.32
▸ PPARD Q03181 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
SCHEMBL19722539 0.97 CNR2 (0.38) CNR2CNR1ITGB3ITGA2BPTGES
SCHEMBL19854652 0.88 CNR2 (0.33) CNR2CNR1ITGB3ITGA2BLNPEP
SCHEMBL21321777 0.88 CNR2 (0.32) CNR2CNR1
SCHEMBL19722002 0.88 CNR2 (0.36) CNR2CNR1ITGB3ITGA2BPTGES
SCHEMBL19722399 0.87 FFAR4 (0.37) CNR2CNR1ITGB3ITGA2BRAB9A
SCHEMBL20313698 0.87 CNR2 (0.32) CNR2CNR1ITGB3ITGA2BLNPEP
SCHEMBL19722175 0.86 CYP2C9 (0.34) —
SCHEMBL19722549 0.86 RAB9A (0.43) ITGB3ITGA2BRAB9A
SCHEMBL19721896 0.85 RARB (0.43) CNR2ITGB3ITGA2BRAB9A
SCHEMBL19722570 0.85 CYP3A4 (0.31) ITGB3ITGA2B

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 CNR2 1694/4885CNR1 1064/4885ITGB3 2716/4885
US-20170369418-A1 POLYMERIZABLE POLAR COMPOUND, LIQUID CRYSTAL COMPOSITION, AND LIQUID CRYSTAL DISPLAY ELEMENT SP1, SPIN1, SAV1 CNR2 2351/4885CNR1 1576/4885ITGB3 3454/4885

“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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