SCHEMBL24904403

SCHEMBL24904403

Cn1cnc(S(=O)(=O)Nc2ccc(-c3ccn(S(N)(=O)=O)c3C(O)O)cc2)c1

nearest known ligand 0.51

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.51
L3MBTL1 Q9Y468 1/20 0.51
ALDH1A1 P00352 1/20 0.48
MAPK1 P28482 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
HTR6 P50406 1/20 0.40
GLO1 Q04760 1/20 0.39
MET P08581 1/20 0.38
LMNA P02545 1/20 0.37
SCN9A Q15858 1/20 0.37
GAA P10253 1/20 0.37
HSD17B1 P14061 1/20 0.37
HSD17B2 P37059 1/20 0.37
KMT2A Q03164 1/20 0.36
FBP1 P09467 1/20 0.36
KDM4E B2RXH2 1/20 0.36

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
SCHEMBL23417226 0.86 TSHR (0.50) TSHRL3MBTL1ALDH1A1MAPK1SMN1; SMN2
SCHEMBL25068449 0.79 CA12 (0.48) ALDH1A1MAPK1KMT2AKDM4E
SCHEMBL23417228 0.77 ALDH1A1 (0.46) TSHRL3MBTL1ALDH1A1MAPK1SMN1; SMN2
SCHEMBL23693471 0.74 PTGS2 (0.38)
SCHEMBL10192089 0.72 TSHR (0.70) TSHRL3MBTL1ALDH1A1MAPK1SMN1; SMN2
SCHEMBL25848742 0.71 TSHR (0.65) TSHRL3MBTL1ALDH1A1MAPK1SMN1; SMN2
SCHEMBL18862468 0.71 TSHR (0.68) TSHRL3MBTL1ALDH1A1MAPK1SMN1; SMN2
SCHEMBL28752749 0.69 TSHR (0.64) TSHRL3MBTL1ALDH1A1MAPK1SMN1; SMN2
SCHEMBL3954491 0.67 TSHR (0.50) TSHRL3MBTL1ALDH1A1MAPK1SMN1; SMN2
SCHEMBL3954482 0.66 TSHR (0.46) TSHRL3MBTL1ALDH1A1MAPK1SMN1; SMN2

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-20230018460-A1 1-AMINOSULFONYL-2-CARBOXYPYRROLE DERIVATIVES AS METALLO-BETA-LACTAMASE INHIBITORS Infex Therapeutics Limited (GB) 2023-01-19 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-20230018460-A1 1-AMINOSULFONYL-2-CARBOXYPYRROLE DERIVATIVES AS METALLO-BETA-LACTAMASE INHIBITORS CPN1, CMBL, ALDH7A1 TSHR 4739/4885L3MBTL1 1631/4885ALDH1A1 143/4885

“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.