SCHEMBL2174952

SCHEMBL2174952

COC(=O)c1cccc2c(S(N)(=O)=O)cn(C)c12

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA9 Q16790 4/20 0.56
CA1 P00915 3/20 0.56
CA2 P00918 3/20 0.56
CA5A P35218 1/20 0.56
NR4A2 P43354 3/20 0.47
BRD4 O60885 2/20 0.46
HSD17B10 Q99714 3/20 0.44
ALDH1A1 P00352 3/20 0.44
KDM4E B2RXH2 2/20 0.44
HPGD P15428 1/20 0.44
TP53 P04637 1/20 0.44
ALOX15 P16050 1/20 0.44
CFTR P13569 1/20 0.43
CA12 O43570 2/20 0.42
LMNA P02545 1/20 0.41
TSHR P16473 1/20 0.41
KMT2A Q03164 3/20 0.40
MEN1 O00255 2/20 0.40
MAPT P10636 1/20 0.40
HTT P42858 1/20 0.38

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
SCHEMBL2175858 0.86 NR4A2 (0.47) CA9CA1CA2CA5ANR4A2
SCHEMBL13806239 0.80 ALDH1A1 (0.56) NR4A2BRD4HSD17B10ALDH1A1KDM4E
SCHEMBL20605270 0.80 NR4A2 (0.51) NR4A2BRD4HSD17B10ALDH1A1KDM4E
SCHEMBL2087675 0.77 BRD4 (0.48) CA9CA1CA2BRD4HSD17B10
SCHEMBL27815526 0.76 FBP1 (0.40) CA9CA1CA2CA5ABRD4
SCHEMBL2175461 0.75 CA2 (0.44) CA9CA1CA2BRD4CA12
SCHEMBL1093623 0.75 ALDH1A1 (0.50) NR4A2BRD4HSD17B10ALDH1A1KDM4E
SCHEMBL1093038 0.73 NR4A2 (0.47) NR4A2BRD4HSD17B10ALDH1A1KDM4E
SCHEMBL30362278 0.73 CA1 (1.00) CA9CA1CA2CA5AHSD17B10
SCHEMBL2181057 0.73 CA1 (1.00) CA9CA1CA2CA5AHSD17B10

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 4 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
EP-2227468-A1 AMINOTHIAZOLE DERIVATIVES F. Hoffmann-La Roche AG (CH) 2010-09-15 EP disclosed
US-20090143448-A1 NEW AMINOTHIAZOLES AS FBPASE INHIBITORS FOR DIABETES F. HOFFMANN-LA ROCHE AG (CH) 2009-06-04 US disclosed
WO-2009068467-A1 AMINOTHIAZOLE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2009-06-04 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-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.