SCHEMBL22816320

SCHEMBL22816320

CCOC(=O)c1nnn(Cc2ccc(OC)cc2)c1Oc1ccc(-c2cccc(O)c2)cc1

nearest known ligand 0.53

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
AKR1C3 P42330 7/20 0.53
CYP19A1 P11511 8/20 0.49
MAPT P10636 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.42
ERCC5 P28715 1/20 0.42
FEN1 P39748 1/20 0.42
ALDH1A1 P00352 1/20 0.42

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
SCHEMBL22816877 0.89 CYP19A1 (0.47) AKR1C3CYP19A1MAPTSMN1; SMN2ERCC5
SCHEMBL22816823 0.87 CYP19A1 (0.48) AKR1C3CYP19A1MAPTSMN1; SMN2ALDH1A1
SCHEMBL22816319 0.87 AKR1C3 (0.49) AKR1C3CYP19A1MAPT
SCHEMBL22815728 0.87 CYP19A1 (0.59) CYP19A1MAPTSMN1; SMN2ALDH1A1
SCHEMBL28047047 0.86 CYP19A1 (0.50) AKR1C3CYP19A1MAPTSMN1; SMN2ALDH1A1
SCHEMBL22816876 0.86 CYP19A1 (0.46) AKR1C3CYP19A1MAPT
SCHEMBL22816326 0.86 CYP19A1 (0.44) AKR1C3CYP19A1MAPTSMN1; SMN2
SCHEMBL22795533 0.85 CYP19A1 (0.57) AKR1C3CYP19A1MAPTSMN1; SMN2ALDH1A1
SCHEMBL22816187 0.85 CYP19A1 (0.44) AKR1C3CYP19A1MAPTSMN1; SMN2ALDH1A1
SCHEMBL23319975 0.84 CYP19A1 (0.47) AKR1C3CYP19A1MAPTSMN1; SMN2ERCC5

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-11384055-B2 Glycolate oxidase inhibitors for the treatment of disease BIOMARIN PHARMACEUTICAL INC. (US) 2022-07-12 US disclosed
US-20210171474-A1 GLYCOLATE OXIDASE INHIBITORS FOR THE TREATMENT OF DISEASE BIOMARIN PHARMACEUTICAL INC. (US) 2021-06-10 US disclosed
WO-2020257487-A1 GLYCOLATE OXIDASE INHIBITORS FOR THE TREATMENT OF DISEASE BIOMARIN PHARMACEUTICAL INC. (US) 2020-12-24 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 (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-11384055-B2 Glycolate oxidase inhibitors for the treatment of disease XDH, PNPO, AGXT AKR1C3 345/4885CYP19A1 1433/4885MAPT 1215/4885
US-20210171474-A1 GLYCOLATE OXIDASE INHIBITORS FOR THE TREATMENT OF DISEASE XDH, PNPO, AGXT AKR1C3 345/4885CYP19A1 1433/4885MAPT 1215/4885

“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.