SCHEMBL2178801

SCHEMBL2178801

COC(=O)c1ccc2c(S(N)(=O)=O)cn(C)c2c1

nearest known ligand 0.45

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CA9 Q16790 12/20 0.45
CA1 P00915 7/20 0.45
CA2 P00918 7/20 0.45
CA4 P22748 2/20 0.45
CA12 O43570 7/20 0.44
CA14 Q9ULX7 3/20 0.44
CA7 P43166 1/20 0.43
XDH P47989 1/20 0.43
LCK P06239 1/20 0.43
CA5A P35218 1/20 0.42
STS P08842 1/20 0.42
SCN9A Q15858 3/20 0.42
SCN5A Q14524 1/20 0.42
BRD4 O60885 1/20 0.41
CREBBP Q92793 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
SCHEMBL2175386 0.89 CA9 (0.52) CA9CA1CA2CA4CA12
SCHEMBL2175671 0.86 ALDH1A1 (0.43) CA9CA1CA2CA12CA14
SCHEMBL17680562 0.81 NR4A2 (0.45) CA9CA1CA2CA12CA14
SCHEMBL19475662 0.80 HSD17B10 (0.47) CA9CA1CA2CA12CA14
SCHEMBL31632933 0.80 HSD17B10 (0.47) CA9CA1CA2CA12CA14
SCHEMBL13806241 0.80 KDM4E (0.51) CA9CA1CA2CA12CA14
SCHEMBL19531634 0.78 SCN9A (0.58) CA9CA1CA2CA12CA14
SCHEMBL31556362 0.77 MAPT (0.45) CA9CA1CA2CA12CA14
SCHEMBL19510180 0.77 MAPT (0.45) CA9CA1CA2CA12CA14
SCHEMBL2495561 0.76 NR4A2 (0.54) CA9CA1CA2CA12CA14

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7973051-B2 Aminothiazoles as FBPase inhibitors for diabetes HOFFMAN-LA ROCHE INC. (US) 2011-07-05 US disclosed
US-20090143448-A1 NEW AMINOTHIAZOLES AS FBPASE INHIBITORS FOR DIABETES F. HOFFMANN-LA ROCHE AG (CH) 2009-06-04 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-20090143448-A1 NEW AMINOTHIAZOLES AS FBPASE INHIBITORS FOR DIABETES FBP1, SLC5A1, DPP4 CA9 2185/4885CA1 3718/4885CA2 1616/4885

“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.