SCHEMBL29852162

SCHEMBL29852162

COc1cc2ccc(-c3nn[nH]c3C(=O)O)cc2cn1

nearest known ligand 0.45

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ HAO1 Q9UJM8 12/20 0.45
▸ ABL1 P00519 1/20 0.41
▸ ALPL P05186 1/20 0.37
▸ CA9 Q16790 1/20 0.37
▸ HSP90AA1 P07900 1/20 0.36
▸ BTK Q06187 1/20 0.36
▸ PRKAG1 P54619 1/20 0.35
▸ PRKAA1 Q13131 1/20 0.35
▸ PRKAB1 Q9Y478 1/20 0.35
▸ KDM2B Q8NHM5 1/20 0.35
▸ NPC1 O15118 1/20 0.35
▸ CASP3 P42574 1/20 0.35
▸ RAB9A P51151 1/20 0.35
▸ SENP7 Q9BQF6 1/20 0.35
▸ CA12 O43570 1/20 0.34

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
SCHEMBL23294498 1.00 HAO1 (0.45) HAO1ABL1ALPLCA9HSP90AA1
SCHEMBL23294475 0.81 ABL1 (0.37) HAO1ABL1ALPLHSP90AA1CA12
SCHEMBL29852148 0.81 ABL1 (0.37) HAO1ABL1ALPLHSP90AA1CA12
SCHEMBL29851969 0.80 NPC1 (0.45) HAO1NPC1CASP3RAB9ASENP7
SCHEMBL23294467 0.80 NPC1 (0.45) HAO1NPC1CASP3RAB9ASENP7
SCHEMBL23294462 0.78 CA12 (0.55) HAO1ALPLCA12
SCHEMBL29852112 0.78 CA12 (0.55) HAO1ALPLCA12
SCHEMBL23294396 0.77 CA12 (0.47) HAO1CA12
SCHEMBL29852146 0.77 CA12 (0.47) HAO1CA12
SCHEMBL23294648 0.76 HAO1 (0.56) HAO1ALPLCA9HSP90AA1PRKAG1

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
CN-114929676-B Heterocyclic carboxylate compounds as glycolate oxidase inhibitors 紫丁香疗法有限公司 2025-04-29 — — CN disclosed
CN-114929676-A Heterocyclic carboxylate compounds as glycolate oxidase inhibitors 紫丁香疗法有限公司 2022-08-19 — — CN disclosed
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