SCHEMBL24348971

SCHEMBL24348971

Cc1nc(COc2ncccn2)sc1-c1cccc(-c2ccc3[nH]c(=O)[nH]c3c2)n1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ BPGM P07738 5/20 0.65
▸ CDC25A P30304 1/20 0.43
▸ CDC25B P30305 1/20 0.43
▸ CDC25C P30307 1/20 0.43
▸ DUSP3 P51452 1/20 0.43
▸ GRIA1 P42261 4/20 0.39
▸ CACNG8 Q8WXS5 4/20 0.39
▸ DYRK1A Q13627 2/20 0.38
▸ KDM4E B2RXH2 1/20 0.38
▸ CDC7 O00311 1/20 0.38
▸ PLK4 O00444 1/20 0.38
▸ DYRK3 O43781 1/20 0.38
▸ ROCK2 O75116 1/20 0.38
▸ MAP4K4 O95819 1/20 0.38
▸ ROS1 P08922 1/20 0.38
▸ MAPT P10636 1/20 0.38
▸ PRKACA P17612 1/20 0.38
▸ RPS6KB1 P23443 1/20 0.38
▸ MARK3 P27448 1/20 0.38
▸ MAPK1 P28482 1/20 0.38

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
SCHEMBL24348919 0.85 BPGM (0.66) BPGMCDC25ACDC25BCDC25CDUSP3
SCHEMBL24348994 0.85 BPGM (0.66) BPGMGRIA1CACNG8DYRK1AKDM4E
SCHEMBL24348967 0.82 BPGM (0.57) BPGMDYRK1AKDM4ECDC7PLK4
SCHEMBL24348973 0.82 BPGM (0.62) BPGMDYRK1AKDM4ECDC7PLK4
SCHEMBL24271848 0.80 BPGM (0.55) BPGMROCK2PRKACAROCK1PPARD
SCHEMBL24271786 0.79 BPGM (0.58) BPGMDYRK1AKDM4ECDC7PLK4
SCHEMBL24349266 0.78 BPGM (1.00) BPGMDYRK1AKDM4ECDC7PLK4
SCHEMBL24349244 0.78 BPGM (0.68) BPGMDYRK1AKDM4ECDC7PLK4
SCHEMBL24271803 0.78 BPGM (0.57) BPGMDYRK1AKDM4ECDC7PLK4
SCHEMBL24271932 0.77 BPGM (0.63) BPGMDYRK1AKDM4ECDC7PLK4

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-20230348454-A1 COMPOUNDS AS MODULATORS OF BIS-PHOSPHOGLYCERATE MUTASE FOR THE TREATMENT OF SICKLE CELL DISEASE GENZYME CORPORATION 2023-11-02 — — US disclosed
WO-2022056449-A1 COMPOUNDS AS MODULATORS OF BIS-PHOSPHOGLYCERATE MUTASE FOR THE TREATMENT OF SICKLE CELL DISEASE GENZYME CORPORATION (US) 2022-03-17 — — 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 (1 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-20230348454-A1 COMPOUNDS AS MODULATORS OF BIS-PHOSPHOGLYCERATE MUTASE FOR THE TREATMENT OF SICKLE CELL DISEASE BPGM, PGAM1, HBG1 BPGM 1/4885CDC25A 1101/4885CDC25B 932/4885

“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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