SCHEMBL29699550

SCHEMBL29699550

Clc1ccc(COc2c[nH]nn2)cc1Cl

nearest known ligand 0.56

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 3/20 0.56
CYP2D6 P10635 2/20 0.56
ALDH1A1 P00352 1/20 0.56
CYP2C19 P33261 1/20 0.56
IDO1 P14902 3/20 0.47
RAB9A P51151 2/20 0.46
MAPT P10636 1/20 0.46
PTPN1 P18031 2/20 0.41
MAOB P27338 3/20 0.41
MAOA P21397 1/20 0.41
SLC6A4 P31645 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
PTPRC P08575 1/20 0.40
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39

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
SCHEMBL29699600 0.80 TEC (0.44) NPC1CYP2D6ALDH1A1CYP2C19MAOB
SCHEMBL23457525 0.80 TEC (0.44) NPC1CYP2D6ALDH1A1CYP2C19MAOB
SCHEMBL4451023 0.74 GABRG2 (0.43) ALDH1A1CYP2C19IDO1RAB9AMAPT
SCHEMBL29699364 0.71 CYP1A2 (0.38) NPC1CYP2D6ALDH1A1CYP2C19RAB9A
SCHEMBL23457572 0.71 CYP1A2 (0.38) NPC1CYP2D6ALDH1A1CYP2C19RAB9A
SCHEMBL29699407 0.70 CYP1A2 (0.48) CYP2D6CYP2C19IDO1MAPTPTPRC
SCHEMBL5649177 0.70 NPC1 (0.59) NPC1CYP2D6ALDH1A1CYP2C19IDO1
SCHEMBL11118881 0.70 MRGPRX4 (0.59) NPC1CYP2D6ALDH1A1CYP2C19IDO1
SCHEMBL26971102 0.69 NPC1 (0.61) NPC1CYP2D6ALDH1A1CYP2C19IDO1
SCHEMBL30873130 0.68 IDO1 (0.68) NPC1CYP2D6ALDH1A1CYP2C19IDO1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230089374-A1 GLYCOLATE OXIDASE INHIBITORS FOR THE TREATMENT OF DISEASE BIOMARIN PHARMACEUTICAL INC. (US) 2023-03-23 US disclosed
US-20230088214-A1 GLYCOLATE OXIDASE INHIBITORS FOR THE TREATMENT OF DISEASE BIOMARIN PHARMACEUTICAL INC. (US) 2023-03-23 US disclosed
US-20230079913-A1 GLYCOLATE OXIDASE INHIBITORS FOR THE TREATMENT OF DISEASE BIOMARIN PHARMACEUTICAL INC. (US) 2023-03-16 US disclosed
US-11384055-B2 Glycolate oxidase inhibitors for the treatment of disease BIOMARIN PHARMACEUTICAL INC. (US) 2022-07-12 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 (4 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-20230079913-A1 GLYCOLATE OXIDASE INHIBITORS FOR THE TREATMENT OF DISEASE XDH, PNPO, AGXT NPC1 1158/4885CYP2D6 557/4885ALDH1A1 481/4885
US-20230088214-A1 GLYCOLATE OXIDASE INHIBITORS FOR THE TREATMENT OF DISEASE XDH, PNPO, AGXT NPC1 1113/4885CYP2D6 542/4885ALDH1A1 552/4885
US-11384055-B2 Glycolate oxidase inhibitors for the treatment of disease XDH, PNPO, AGXT NPC1 1158/4885CYP2D6 557/4885ALDH1A1 481/4885
US-20230089374-A1 GLYCOLATE OXIDASE INHIBITORS FOR THE TREATMENT OF DISEASE XDH, PNPO, AGXT NPC1 1158/4885CYP2D6 557/4885ALDH1A1 481/4885

“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.