SCHEMBL23329266

SCHEMBL23329266

OCc1[nH]nnc1-c1ccc2cc(-c3ccccc3)ncc2c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 6/20 0.45
▸ RAB9A P51151 5/20 0.45
▸ CASP3 P42574 1/20 0.38
▸ SENP7 Q9BQF6 1/20 0.38
▸ IDO1 P14902 3/20 0.37
▸ TDO2 P48775 3/20 0.37
▸ MAP4K4 O95819 1/20 0.36
▸ TYK2 P29597 1/20 0.36
▸ MINK1 Q8N4C8 1/20 0.36
▸ SRPK1 Q96SB4 1/20 0.36
▸ CLK4 Q9HAZ1 1/20 0.36
▸ AKT1 P31749 1/20 0.36
▸ CA12 O43570 1/20 0.35
▸ FYN P06241 2/20 0.35
▸ DYRK1A Q13627 1/20 0.35
▸ NOTUM Q6P988 1/20 0.34
▸ GSK3A P49840 1/20 0.34
▸ GSK3B P49841 1/20 0.34
▸ ADORA2A P29274 1/20 0.34
▸ ADORA1 P30542 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
SCHEMBL29851969 0.81 NPC1 (0.45) NPC1RAB9ACASP3SENP7IDO1
SCHEMBL23294467 0.81 NPC1 (0.45) NPC1RAB9ACASP3SENP7IDO1
SCHEMBL23328899 0.78 ESR1 (0.45) CA12NOTUMADORA2AADORA1
SCHEMBL23329217 0.74 GP6 (0.41) NPC1CLK4DYRK1AGSK3B
SCHEMBL23329267 0.72 KDM4E (0.41) NPC1RAB9A
SCHEMBL23329080 0.67 MKNK1 (0.55) CA12FYN
SCHEMBL29838915 0.67 NPC1 (0.67) NPC1RAB9ACASP3SENP7IDO1
SCHEMBL29493150 0.67 NPC1 (0.67) NPC1RAB9ACASP3SENP7IDO1
SCHEMBL729768 0.67 NPC1 (0.67) NPC1RAB9ACASP3SENP7IDO1
SCHEMBL23328939 0.66 HDAC8 (0.41) CA12

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 NPC1 4018/4885RAB9A 4019/4885CASP3 3091/4885
US-20210128532-A1 HETEROCYCLIC CARBOXYLATE COMPOUNDS AS GLYCOLATE OXIDASE INHIBITORS UGDH, PGD, PNPO NPC1 4018/4885RAB9A 4019/4885CASP3 3091/4885

“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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