SCHEMBL24348045

SCHEMBL24348045

Cc1nc(COC(=O)N2CCC(O)CC2)sc1-c1cccc(-c2cc(F)c3nn[nH]c3c2F)n1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ BPGM P07738 6/20 0.47
▸ HTR2C P28335 2/20 0.34
▸ TRPC3 Q13507 2/20 0.34
▸ TRPC7 Q9HCX4 2/20 0.34
▸ GRIN2B Q13224 3/20 0.32
▸ BRD4 O60885 1/20 0.32
▸ KDM4E B2RXH2 4/20 0.32
▸ ALDH1A1 P00352 4/20 0.32
▸ GAA P10253 2/20 0.32
▸ MAPK1 P28482 2/20 0.32
▸ HSD17B10 Q99714 2/20 0.32
▸ HPGD P15428 2/20 0.32
▸ MAP4K4 O95819 1/20 0.32
▸ ABL1 P00519 1/20 0.32
▸ POLB P06746 1/20 0.32
▸ MAPT P10636 1/20 0.32
▸ HTT P42858 1/20 0.32
▸ ATM Q13315 1/20 0.32
▸ RIN1 Q13671 1/20 0.32
▸ MAP3K5 Q99683 1/20 0.31

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
SCHEMBL24349248 0.95 BPGM (0.46) BPGMHTR2CTRPC3TRPC7GRIN2B
SCHEMBL24348425 0.92 BPGM (0.48) BPGMGRIN2BMAP3K5
SCHEMBL24348462 0.91 BPGM (0.45) BPGMTRPC3TRPC7GRIN2BMAP4K4
SCHEMBL24348391 0.91 BPGM (0.44) BPGMTRPC3TRPC7GRIN2B
SCHEMBL24348468 0.90 BPGM (0.44) BPGMTRPC3TRPC7GRIN2BMAP4K4
SCHEMBL24348019 0.87 BPGM (0.50) BPGMHTR2CPOLBMAPT
SCHEMBL24348454 0.87 BPGM (0.45) BPGMMAP3K5
SCHEMBL24349259 0.87 BPGM (0.37) BPGMGRIN2B
SCHEMBL24349410 0.86 BPGM (0.44) BPGMMAP3K5
SCHEMBL24348430 0.86 BPGM (0.36) BPGMTRPC3TRPC7GRIN2B

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 1/4885HTR2C 4366/4885TRPC3 3860/4885

“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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