Methyl Syringate

Methyl Syringate

SCHEMBL30311469

[2H]C([2H])([2H])Oc1cc(C(=O)OC)cc(OC([2H])([2H])[2H])c1OC([2H])([2H])[2H]

nearest known ligand 0.48

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 4/20 0.47
▸ ALDH1A1 P00352 3/20 0.47
▸ CA12 O43570 1/20 0.47
▸ CA1 P00915 1/20 0.47
▸ CA2 P00918 1/20 0.47
▸ CA7 P43166 1/20 0.47
▸ CA9 Q16790 1/20 0.47
▸ CA14 Q9ULX7 1/20 0.47
▸ MEN1 O00255 3/20 0.46
▸ KMT2A Q03164 3/20 0.46
▸ LMNA P02545 1/20 0.46
▸ POLB P06746 1/20 0.46
▸ GAA P10253 1/20 0.46
▸ NFKB1 P19838 1/20 0.46
▸ XDH P47989 1/20 0.46
▸ GFER P55789 1/20 0.46
▸ NFKB2 Q00653 1/20 0.46
▸ RELA Q04206 1/20 0.46
▸ FUT7 Q11130 1/20 0.46
▸ TDP1 Q9NUW8 1/20 0.46

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
SCHEMBL22026533 0.85 KMT2A (0.50) KDM4EALDH1A1CA12CA1CA2
Methyl Syringate SCHEMBL211747 0.84 MEN1 (0.61) KDM4EALDH1A1CA12CA1CA2
SCHEMBL31492679 0.82 TUBB4A (0.53) CYP3A4TSHR
SCHEMBL31492675 0.82 TUBB4A (0.53) CYP3A4TSHR
SCHEMBL30625037 0.81 LMNA (0.52) KDM4EALDH1A1MEN1KMT2ALMNA
Veratric Acid Methyl Ester SCHEMBL2371276 0.80 MAPT (0.70) KDM4EALDH1A1CA12CA1CA2
SCHEMBL29728532 0.80 TUBB4A (0.44) KDM4EALDH1A1MEN1KMT2ALMNA
SCHEMBL29728529 0.79 TUBB4A (0.39) KDM4EALDH1A1MEN1KMT2ALMNA
3,4,5-Trimethoxybenzamide SCHEMBL29597349 0.79 TSHR (0.54) ALDH1A1MEN1KMT2ALMNATSHR
Veratric Acid Methyl Ester SCHEMBL3661352 0.79 MAPT (0.73) KDM4EALDH1A1CA12CA1CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240368183-A1 Macrocyclic Compounds Having ENT1 Inhibiting Activity iTeos Belgium SA (BE) 2024-11-07 — — US disclosed
EP-4413004-A1 MACROCYCLIC COMPOUNDS HAVING ENT1 INHIBITING ACTIVITY iTeos Belgium SA (BE) 2024-08-14 — — EP disclosed
WO-2023059739-A1 MACROCYCLIC COMPOUNDS HAVING ENT1 INHIBITING ACTIVITY iTeos Belgium SA (US) 2023-04-13 — — 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-20240368183-A1 Macrocyclic Compounds Having ENT1 Inhibiting Activity ENTPD5, ENTPD1, ENTPD8 KDM4E 3768/4885ALDH1A1 363/4885CA12 2350/4885

“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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