SCHEMBL22459320

SCHEMBL22459320

C=C(C)C(=O)OCCCc1ccc(-c2ccc(CCCOC(=O)C(=C)COC)cc2F)cc1

nearest known ligand 0.41

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ RARB P10826 1/20 0.41
▸ KDM1A O60341 2/20 0.35
▸ POLB P06746 1/20 0.34
▸ APEX1 P27695 1/20 0.34
▸ HTT P42858 1/20 0.34
▸ TDP1 Q9NUW8 1/20 0.34
▸ TSHR P16473 2/20 0.33
▸ S1PR1 P21453 2/20 0.33
▸ S1PR3 Q99500 2/20 0.33
▸ PTGES O14684 1/20 0.32
▸ TNKS2 Q9H2K2 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
SCHEMBL22459333 0.94 POLB (0.37) RARBKDM1APOLBAPEX1HTT
SCHEMBL22459328 0.91 S1PR1 (0.41) RARBPOLBAPEX1HTTTDP1
SCHEMBL22459611 0.90 RARB (0.43) RARBKDM1ATSHRS1PR1S1PR3
SCHEMBL22459317 0.88 RARB (0.40) RARBPOLBAPEX1HTTTDP1
SCHEMBL22459240 0.88 TNKS2 (0.41) POLBAPEX1HTTTDP1TNKS2
SCHEMBL22459804 0.87 POLB (0.41) RARBPOLBAPEX1HTTTDP1
SCHEMBL22459329 0.87 RARB (0.36) RARBKDM1A
SCHEMBL22459375 0.85 CHRM5 (0.35) RARBKDM1AS1PR1
SCHEMBL22459777 0.85 RARB (0.43) RARBPOLBAPEX1HTTTDP1
SCHEMBL22459521 0.84 RARB (0.38) RARBPOLBAPEX1HTTTDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 RARB 3668/4885KDM1A 294/4885POLB 3467/4885

“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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