SCHEMBL6416281

SCHEMBL6416281

C[C@@H](O)c1csc(-c2ccccc2[N+](=O)[O-])n1

nearest known ligand 0.46

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MGAM O43451 1/20 0.46
GAA P10253 1/20 0.46
SI P14410 1/20 0.46
MGAM2 Q2M2H8 1/20 0.46
EIF4E P06730 17/20 0.45
ALDH1A1 P00352 1/20 0.41
TDP1 Q9NUW8 1/20 0.41

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
SCHEMBL6416284 1.00 MGAM (0.46) MGAMGAASIMGAM2EIF4E
SCHEMBL829974 0.78 MGAM (0.51) MGAMGAASIMGAM2EIF4E
SCHEMBL6416859 0.76 ALDH1A1 (0.42) GAAALDH1A1TDP1
SCHEMBL6416853 0.76 ALDH1A1 (0.42) GAAALDH1A1TDP1
SCHEMBL9832354 0.75 MGAM (0.59) MGAMGAASIMGAM2EIF4E
SCHEMBL6185761 0.74 ACHE (0.56) EIF4E
SCHEMBL1208143 0.72 EIF4E (0.70) EIF4EALDH1A1TDP1
SCHEMBL6225006 0.71 KDM4E (0.52) GAAEIF4EALDH1A1
SCHEMBL6225000 0.71 KDM4E (0.52) GAAEIF4EALDH1A1
SCHEMBL6414430 0.71 MGAM (0.45) MGAMGAASIMGAM2EIF4E

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050277676-A1 M3muscarinic acetylcholine receptor antagonists GLAXO GROUP LIMITED (GB) 2005-12-15 US 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-20050277676-A1 M3muscarinic acetylcholine receptor antagonists CHRM3, CHRM2, CHRM5 MGAM 2067/4885GAA 4513/4885SI 3969/4885

“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.