SCHEMBL24271767

SCHEMBL24271767

Cc1nc(COc2ncccn2)sc1-c1nc(-c2ccc(C(=O)O)cc2)cs1

nearest known ligand 0.53

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ BPGM P07738 2/20 0.53
▸ KDM4E B2RXH2 8/20 0.50
▸ RAB9A P51151 7/20 0.50
▸ NPC1 O15118 6/20 0.50
▸ SMN1; SMN2 Q16637 5/20 0.50
▸ ALDH1A1 P00352 3/20 0.48
▸ MEN1 O00255 3/20 0.46
▸ KMT2A Q03164 3/20 0.46
▸ CYP19A1 P11511 5/20 0.46
▸ POLB P06746 1/20 0.46
▸ GAA P10253 1/20 0.46
▸ HTT P42858 1/20 0.46
▸ MAPT P10636 1/20 0.41
▸ RARA P10276 1/20 0.40
▸ RARB P10826 1/20 0.40
▸ RARG P13631 1/20 0.40
▸ EIF4E P06730 1/20 0.39
▸ SREBF2 Q12772 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
SCHEMBL24271932 0.85 BPGM (0.63) BPGMKDM4ERAB9ANPC1MEN1
SCHEMBL24271998 0.85 BPGM (0.48) BPGMKDM4ERAB9ANPC1MEN1
SCHEMBL24271939 0.76 BPGM (0.52) BPGMKDM4ERAB9ANPC1SMN1; SMN2
SCHEMBL24272015 0.75 KDM4E (0.57) KDM4ERAB9ANPC1SMN1; SMN2ALDH1A1
SCHEMBL24272267 0.75 BPGM (0.51) BPGMKDM4ERAB9ANPC1ALDH1A1
SCHEMBL24271770 0.74 BPGM (0.50) BPGMKDM4ERAB9ANPC1SMN1; SMN2
SCHEMBL24271811 0.74 BPGM (0.55) BPGMKDM4EKMT2APOLBMAPT
SCHEMBL24272024 0.74 BPGM (0.50) BPGMKDM4EALDH1A1MEN1KMT2A
SCHEMBL24271769 0.73 BPGM (0.52) BPGMKDM4EALDH1A1MEN1KMT2A
SCHEMBL24271731 0.73 RAB9A (0.50) KDM4ERAB9ANPC1SMN1; SMN2ALDH1A1

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 1/4885KDM4E 3317/4885RAB9A 1778/4885

“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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