SCHEMBL22459370

SCHEMBL22459370

C=CC(=O)OCCCc1ccc(-c2ccc(OCCOC(=O)C(=C)COC)cc2)c(F)c1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ THRB P10828 2/20 0.40
▸ S1PR1 P21453 2/20 0.35
▸ S1PR3 Q99500 2/20 0.35
▸ RARB P10826 2/20 0.34
▸ PTGES O14684 1/20 0.34
▸ FFAR1 O14842 4/20 0.34
▸ FFAR4 Q5NUL3 4/20 0.34
▸ RARA P10276 1/20 0.34
▸ KDM1A O60341 1/20 0.34
▸ PPARG P37231 1/20 0.33
▸ MET P08581 1/20 0.32
▸ POLB P06746 1/20 0.32
▸ APEX1 P27695 1/20 0.32
▸ HTT P42858 1/20 0.32
▸ TDP1 Q9NUW8 1/20 0.32
▸ HPGD P15428 1/20 0.32
▸ TSHR P16473 1/20 0.32
▸ CA12 O43570 2/20 0.32
▸ CA1 P00915 2/20 0.32
▸ CA2 P00918 2/20 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
SCHEMBL22561021 0.93 THRB (0.38) THRBS1PR1S1PR3RARBPTGES
SCHEMBL22459560 0.90 THRB (0.44) THRBRARBPTGESFFAR1FFAR4
SCHEMBL22459260 0.89 RARB (0.39) THRBS1PR1S1PR3RARBRARA
SCHEMBL22459777 0.88 RARB (0.43) S1PR1S1PR3RARBPTGESFFAR1
SCHEMBL22459349 0.88 THRB (0.47) THRBFFAR1PPARGMETPOLB
SCHEMBL22459335 0.86 THRB (0.38) THRBRARBFFAR1FFAR4PPARG
SCHEMBL22561041 0.86 S1PR1 (0.44) S1PR1S1PR3RARBPTGESFFAR1
SCHEMBL22459694 0.86 MET (0.38) THRBS1PR1PPARGMET
SCHEMBL22459251 0.86 THRB (0.38) THRBFFAR1FFAR4PPARGMET
SCHEMBL22459328 0.84 S1PR1 (0.41) S1PR1S1PR3RARBPTGESFFAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3725764-A1 POLYMERIZABLE COMPOUND HAVING METHOXYMETHYL ACRYLIC GROUP, LIQUID CRYSTAL COMPOSITION, AND LIQUID CRYSTAL DISPLAY DEVICE JNC Corporation (JP) 2020-10-21 — — EP disclosed
US-20200299578-A1 POLYMERIZABLE COMPOUND HAVING METHOXYMETHYL ACRYLIC GROUP, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE JNC CORPORATION (JP) 2020-09-24 — — US 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-20200299578-A1 POLYMERIZABLE COMPOUND HAVING METHOXYMETHYL ACRYLIC GROUP, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE SP1, CCND1, CPNE4 THRB 4816/4885S1PR1 756/4885S1PR3 1399/4885

“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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