SCHEMBL8212136

SCHEMBL8212136

CS(=O)(=O)c1ccc(NCCO)cc1

nearest known ligand 0.52

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
GHSR Q92847 1/20 0.47
ENPP2 Q13822 2/20 0.47
TGM2 P21980 1/20 0.46
CA12 O43570 4/20 0.44
CA1 P00915 4/20 0.44
CA2 P00918 4/20 0.44
CA9 Q16790 4/20 0.44
CA5A P35218 2/20 0.44
CA14 Q9ULX7 2/20 0.44
CA3 P07451 1/20 0.44
CA4 P22748 1/20 0.44
CA6 P23280 1/20 0.44
CA7 P43166 1/20 0.44
ABCB11 O95342 1/20 0.42
ESR2 Q92731 2/20 0.42
CA5B Q9Y2D0 1/20 0.41
PTGS2 P35354 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
SCHEMBL13589510 0.82 PTGS2 (0.50) GHSRENPP2TGM2CA12CA1
SCHEMBL11149031 0.82 CA1 (0.46) CA12CA1CA2CA9CA5A
Sulfuric Acid SCHEMBL30019534 0.81 CA12 (0.43) CA12CA1CA2CA9CA5A
SCHEMBL13589540 0.81 CA1 (0.45) GHSRENPP2TGM2CA12CA1
SCHEMBL5969283 0.81 GHSR (0.37) GHSRENPP2CA12CA1CA2
SCHEMBL6150769 0.81 CA1 (0.45) GHSRENPP2TGM2CA12CA1
SCHEMBL27540686 0.81 CA2 (0.62) CA12CA1CA2CA9CA5A
SCHEMBL9682966 0.81 FLT3 (0.46) TGM2ESR2PTGS2
SCHEMBL13588723 0.80 CA1 (0.45) CA12CA1CA2CA9CA5A
SCHEMBL5923863 0.79 PTGS2 (0.52) GHSRCA1CA2CA9PTGS2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2010024356-A1 NOVEL HYDROXAMIC ACID DERIVATIVE HAVING NAPHTHYRIDINE-N-OXIDE 大正製薬株式会社 (JP) 2010-03-04 WO disclosed
US-20090298878-A1 OXIME COMPOUNDS AND THE USE THEREOF PURDUE PHARMA L.P. 2009-12-03 US disclosed
WO-2008008398-A2 OXIME COMPOUNDS AND THE USE THEREOF SHIONOGI & CO., LTD. (JP) 2008-01-17 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-20090298878-A1 OXIME COMPOUNDS AND THE USE THEREOF KCNN4, CACNA1A, KCNN3 GHSR 1562/4885ENPP2 1210/4885TGM2 4333/4885

“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.