SCHEMBL24348486

SCHEMBL24348486

Cc1nc(COCC(=O)N2CCN(CCO)CC2)sc1-c1csc(-c2cc(F)c(O)c(F)c2F)n1

nearest known ligand 0.57

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ BPGM P07738 5/20 0.57
▸ PIK3CD O00329 1/20 0.32
▸ PIK3CA P42336 1/20 0.32
▸ STAT3 P40763 1/20 0.32
▸ ENPP2 Q13822 1/20 0.32
▸ PIK3CG P48736 1/20 0.31
▸ GRM5 P41594 3/20 0.31
▸ MAPT P10636 2/20 0.30
▸ KDM4E B2RXH2 1/20 0.30
▸ ALDH1A1 P00352 1/20 0.30
▸ MAPK14 Q16539 1/20 0.30
▸ PARP1 P09874 1/20 0.30

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
SCHEMBL24349009 0.93 BPGM (0.60) BPGMPIK3CDPIK3CAGRM5MAPT
SCHEMBL24348968 0.91 BPGM (0.62) BPGMPIK3CDPIK3CAPIK3CGGRM5
SCHEMBL24348043 0.89 BPGM (0.59) BPGMPIK3CDPIK3CAMAPK14
SCHEMBL24348999 0.85 BPGM (0.57) BPGMPIK3CDPIK3CAENPP2PIK3CG
SCHEMBL24348485 0.83 BPGM (0.69) BPGMPIK3CDPIK3CAPIK3CGMAPT
SCHEMBL24349243 0.82 BPGM (0.67) BPGMPIK3CDPIK3CAMAPTALDH1A1
SCHEMBL24348500 0.78 BPGM (0.60) BPGMPIK3CDPIK3CA
SCHEMBL24348035 0.77 BPGM (0.55) BPGMPIK3CDPIK3CAPIK3CG
SCHEMBL24348057 0.76 BPGM (0.69) BPGMPIK3CDPIK3CAMAPTALDH1A1
SCHEMBL24348039 0.76 BPGM (0.71) BPGMPIK3CDPIK3CAPIK3CGMAPT

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-20230348454-A1 COMPOUNDS AS MODULATORS OF BIS-PHOSPHOGLYCERATE MUTASE FOR THE TREATMENT OF SICKLE CELL DISEASE GENZYME CORPORATION 2023-11-02 — — US disclosed
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 1/4885PIK3CD 1201/4885PIK3CA 568/4885

“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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