SCHEMBL24349240

SCHEMBL24349240

Cc1nc(COCC(=O)N(C)C)sc1-c1cccc(-c2cc(F)c3nn[nH]c3c2)n1

nearest known ligand 0.47

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ BPGM P07738 6/20 0.47
▸ PPARD Q03181 10/20 0.34
▸ GPR52 Q9Y2T5 2/20 0.32
▸ MAPT P10636 1/20 0.31
▸ RAB9A P51151 1/20 0.31
▸ COMT P21964 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
SCHEMBL24349278 0.88 BPGM (0.44) BPGMPPARDGPR52MAPTRAB9A
SCHEMBL24348431 0.84 BPGM (0.56) BPGMPPARDMAPTRAB9A
SCHEMBL24348921 0.84 BPGM (0.64) BPGMPPARDGPR52MAPT
SCHEMBL24348976 0.82 BPGM (0.52) BPGMPPARDGPR52MAPT
SCHEMBL24348054 0.81 BPGM (0.55) BPGMPPARDMAPT
SCHEMBL26704310 0.81 BPGM (0.46) BPGMPPARDGPR52MAPT
SCHEMBL24349408 0.81 BPGM (0.64) BPGMPPARDMAPTCOMT
SCHEMBL24349237 0.80 BPGM (0.51) BPGMGPR52MAPTRAB9A
SCHEMBL24348977 0.80 BPGM (0.54) BPGMMAPT
SCHEMBL24349263 0.79 BPGM (0.49) BPGMMAPT

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 1/4885PPARD 1757/4885GPR52 3680/4885

“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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