SCHEMBL23328939

SCHEMBL23328939

OCc1[nH]nnc1-c1ccc(-c2cccc3ccccc23)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HDAC8 Q9BY41 1/20 0.41
▸ HDAC6 Q9UBN7 1/20 0.41
▸ ENPP3 O14638 1/20 0.40
▸ ENPP1 P22413 1/20 0.40
▸ CA12 O43570 2/20 0.39
▸ CA1 P00915 2/20 0.39
▸ CA2 P00918 2/20 0.39
▸ CA9 Q16790 2/20 0.39
▸ PPARG P37231 8/20 0.38
▸ PPARA Q07869 8/20 0.38
▸ CYP2C9 P11712 2/20 0.37
▸ CYP2C19 P33261 2/20 0.37
▸ PPARD Q03181 1/20 0.37
▸ MCL1 Q07820 1/20 0.37
▸ ACMSD Q8TDX5 1/20 0.37
▸ CYP1A2 P05177 1/20 0.36
▸ MAPK13 O15264 1/20 0.36
▸ GCGR P47871 1/20 0.36
▸ MAPK12 P53778 1/20 0.36
▸ MAPK11 Q15759 1/20 0.36

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
SCHEMBL18006098 0.79 MCL1 (0.42) HDAC8HDAC6ENPP3ENPP1CA12
SCHEMBL23328899 0.78 ESR1 (0.45) CA12CA1CA2CA9CYP2C9
SCHEMBL23294386 0.78 MCL1 (0.47) HDAC8HDAC6CA12CA1CA2
SCHEMBL29851928 0.78 MCL1 (0.47) HDAC8HDAC6CA12CA1CA2
SCHEMBL23329217 0.78 GP6 (0.41) ACMSDALDH1A1MAPTHPGD
SCHEMBL9221385 0.75 MAPK11 (0.40) CYP2C19CYP1A2MAPK11MAPK14ALDH1A1
SCHEMBL27626103 0.73 ALDH1A1 (0.43) MAPK13GCGRMAPK12MAPK11MAPK14
SCHEMBL9300231 0.72 BCHE (0.40) MAPK11MAPK14ALDH1A1MAPTHPGD
SCHEMBL23329267 0.72 KDM4E (0.41) CYP2C9CYP2C19CYP1A2MAPK14ALDH1A1
SCHEMBL3798335 0.72 CA12 (0.62) HDAC8HDAC6ENPP3ENPP1CA12

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
US-11806335-B2 Heterocyclic carboxylate compounds as glycolate oxidase inhibitors Lilac Therapeutics, Inc. (US) 2023-11-07 — — US disclosed
US-20210128532-A1 HETEROCYCLIC CARBOXYLATE COMPOUNDS AS GLYCOLATE OXIDASE INHIBITORS Lilac Therapeutics, Inc. 2021-05-06 — — 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 (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-11806335-B2 Heterocyclic carboxylate compounds as glycolate oxidase inhibitors UGDH, PGD, PNPO HDAC8 2116/4885HDAC6 2017/4885ENPP3 182/4885
US-20210128532-A1 HETEROCYCLIC CARBOXYLATE COMPOUNDS AS GLYCOLATE OXIDASE INHIBITORS UGDH, PGD, PNPO HDAC8 2116/4885HDAC6 2017/4885ENPP3 182/4885

“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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