SCHEMBL23732255

SCHEMBL23732255

CCOC(=O)c1c(S(N)(=O)=O)c(CC)n(N)c1CC

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 5/20 0.40
CA2 P00918 5/20 0.40
SMN1; SMN2 Q16637 3/20 0.40
MAPT P10636 3/20 0.40
CA12 O43570 3/20 0.40
CA9 Q16790 3/20 0.40
ALDH1A1 P00352 2/20 0.40
GAA P10253 2/20 0.40
HPGD P15428 2/20 0.40
CA7 P43166 1/20 0.40
CA14 Q9ULX7 1/20 0.40
NR1H2 P55055 1/20 0.39
NR1H3 Q13133 1/20 0.39
FHIT P49789 1/20 0.37
STS P08842 1/20 0.37
KMT2A Q03164 3/20 0.36
CYP3A4 P08684 2/20 0.36
TDP1 Q9NUW8 1/20 0.36
HSD17B10 Q99714 1/20 0.36
NPC1 O15118 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
SCHEMBL23127817 0.85 KMT2A (0.43) CA1CA2SMN1; SMN2MAPTCA12
SCHEMBL23732218 0.82 KMT2A (0.46) CA1CA2SMN1; SMN2MAPTCA12
SCHEMBL23732248 0.81 CA12 (0.30) CA1CA2CA12CA7
SCHEMBL23732222 0.76 KMT2A (0.38) CA1CA2SMN1; SMN2MAPTCA12
SCHEMBL23127813 0.75 KMT2A (0.53) KMT2AUSP2MEN1
SCHEMBL23732220 0.72 ALDH1A1 (0.51) SMN1; SMN2MAPTCA12CA9ALDH1A1
SCHEMBL23732217 0.72 ALDH1A1 (0.48) SMN1; SMN2MAPTCA12CA9ALDH1A1
SCHEMBL23112883 0.71 CA1 (0.41) CA1CA2SMN1; SMN2MAPTCA12
SCHEMBL23732189 0.71 KDM4E (0.40) CA1CA2CA12CA9ALDH1A1
SCHEMBL23732168 0.69 KMT2A (0.45) KMT2AUSP2MEN1

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-20210236463-A1 beta-LACTAMASE INHIBITOR NATIONAL UNIVERSITY CORPORATION TOKAI NATIONAL HIGHER EDUCATION AND RESEARCH SYSTEM (JP) 2021-08-05 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-20210236463-A1 beta-LACTAMASE INHIBITOR MGAM, CMBL, MGAM2 CA1 1685/4885CA2 1433/4885SMN1; SMN2 3073/4885

“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.