SCHEMBL24272083

SCHEMBL24272083

COC(=O)NCc1nc(C)c(-c2csc(-c3cc(O)c(C(=O)O)cc3F)c2)s1

nearest known ligand 0.49

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ BPGM P07738 2/20 0.49
▸ MEN1 O00255 2/20 0.33
▸ KMT2A Q03164 2/20 0.33
▸ GAA P10253 1/20 0.33
▸ XDH P47989 1/20 0.33
▸ HPGDS O60760 1/20 0.32
▸ PRMT5 O14744 1/20 0.32
▸ WDR77 Q9BQA1 1/20 0.32
▸ GPR52 Q9Y2T5 2/20 0.30
▸ RORC P51449 1/20 0.30
▸ NPC1 O15118 1/20 0.30
▸ MAPT P10636 1/20 0.30
▸ RAB9A P51151 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
SCHEMBL24272275 0.89 BPGM (0.38) BPGMMEN1KMT2AGAAXDH
SCHEMBL24272012 0.87 BPGM (0.39) BPGMMEN1KMT2AGAAXDH
SCHEMBL24348950 0.86 BPGM (0.48) BPGM
SCHEMBL24272064 0.85 GPR52 (0.35) BPGMMEN1KMT2AGAAXDH
SCHEMBL24271879 0.85 BPGM (0.66) BPGMMEN1KMT2AGAAXDH
SCHEMBL24272084 0.85 BPGM (0.50) BPGMMEN1KMT2AGAAXDH
SCHEMBL24272082 0.84 BPGM (0.43) BPGMMEN1KMT2AGAAXDH
SCHEMBL24272076 0.83 GPR52 (0.43) GPR52RORC
SCHEMBL24348949 0.82 BPGM (0.49) BPGMNPC1MAPTRAB9A
SCHEMBL24272062 0.82 MEN1 (0.44) MEN1KMT2AGAAXDHHPGDS

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-20230348450-A1 CARBOXYLIC ACID-CONTAINING COMPOUNDS AS MODULATORS OF BIS-PHOSPHOGLYCERATE MUTASE FOR THE TREATMENT OF SICKLE CELL DISEASE GENZYME CORPORATION 2023-11-02 — — US disclosed
US-20230348450-A1 CARBOXYLIC ACID-CONTAINING COMPOUNDS AS MODULATORS OF BIS-PHOSPHOGLYCERATE MUTASE FOR THE TREATMENT OF SICKLE CELL DISEASE GENZYME CORPORATION 2023-11-02 — — US disclosed
WO-2022056447-A1 CARBOXYLIC ACID-CONTAINING 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-20230348450-A1 CARBOXYLIC ACID-CONTAINING COMPOUNDS AS MODULATORS OF BIS-PHOSPHOGLYCERATE MUTASE FOR THE TREATMENT OF SICKLE CELL DISEASE BPGM, PGAM1, PGM2 BPGM 1/4885MEN1 3174/4885KMT2A 2181/4885

“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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