SCHEMBL22459820

SCHEMBL22459820

C=C(C)C(=O)OCCOc1ccc(-c2ccc(OCCOC(=O)C(=C)COC)cc2OCCCC)cc1

nearest known ligand 0.42

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 1/20 0.42
▸ APEX1 P27695 1/20 0.42
▸ HTT P42858 1/20 0.42
▸ TDP1 Q9NUW8 1/20 0.42
▸ PTPN11 Q06124 2/20 0.39
▸ TSHR P16473 2/20 0.37
▸ GCGR P47871 1/20 0.37
▸ ALPL P05186 1/20 0.37
▸ RARB P10826 6/20 0.36
▸ MEN1 O00255 1/20 0.35
▸ ALDH1A1 P00352 1/20 0.35
▸ KMT2A Q03164 1/20 0.35
▸ FFAR1 O14842 2/20 0.35
▸ FFAR4 Q5NUL3 2/20 0.35
▸ PPARD Q03181 1/20 0.35
▸ CYP11B1 P15538 1/20 0.35
▸ CYP11B2 P19099 1/20 0.35
▸ RARA P10276 1/20 0.35
▸ CHEK2 O96017 1/20 0.35

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
SCHEMBL22459837 0.92 POLB (0.41) POLBAPEX1HTTTDP1PTPN11
SCHEMBL22459247 0.91 POLB (0.42) POLBAPEX1HTTTDP1TSHR
SCHEMBL22459844 0.91 POLB (0.42) POLBAPEX1HTTTDP1TSHR
SCHEMBL22459603 0.90 ALPL (0.41) POLBAPEX1HTTTDP1PTPN11
SCHEMBL22083062 0.87 PPARG (0.40) POLBAPEX1HTTTDP1PTPN11
SCHEMBL22083061 0.87 POLB (0.42) POLBAPEX1HTTTDP1PTPN11
SCHEMBL22459332 0.86 PPARD (0.39) MEN1KMT2AFFAR4PPARDCYP11B1
SCHEMBL22459860 0.86 EGFR (0.43) POLBAPEX1HTTTDP1RARB
SCHEMBL22083060 0.86 POLB (0.40) POLBAPEX1HTTTDP1PTPN11
SCHEMBL22459417 0.85 BACE1 (0.39) POLBAPEX1HTTTDP1PPARD

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 POLB 3467/4885APEX1 1393/4885HTT 4603/4885

“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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