SCHEMBL7248592

SCHEMBL7248592

CN(C)S(=O)(=O)N[C@@H](CN)C(=O)O

nearest known ligand 0.38

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CA1 P00915 1/20 0.37
CA2 P00918 1/20 0.37
TGFBR1 P36897 3/20 0.33
ALDH1A1 P00352 1/20 0.31
MMP2 P08253 1/20 0.31
MMP9 P14780 1/20 0.31
ARG1 P05089 1/20 0.31
ITGB3 P05106 1/20 0.31
ITGA2B P08514 1/20 0.31
KDM4E B2RXH2 1/20 0.31
MAPT P10636 1/20 0.31
THRB P10828 1/20 0.31
ALOX15 P16050 1/20 0.31
NFKB1 P19838 1/20 0.31
PTGS2 P35354 1/20 0.31
THPO P40225 1/20 0.31
RECQL P46063 1/20 0.31
BLM P54132 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31

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
SCHEMBL8088640 0.81 CA2 (0.32) CA1CA2TGFBR1MMP2MMP9
SCHEMBL15251818 0.79 ALDH1A1 (0.48) CA1CA2ALDH1A1MMP2MMP9
SCHEMBL8080233 0.76 ITGB3 (0.36) CA2TGFBR1ALDH1A1MMP2MMP9
SCHEMBL6976447 0.74 GABRR1 (0.34) CA1CA2TGFBR1ALDH1A1MMP2
SCHEMBL7378230 0.74 GABRR1 (0.34) CA1CA2TGFBR1ALDH1A1MMP2
SCHEMBL5230591 0.73 CA2 (0.51) CA2ALDH1A1MMP2MMP9ITGB3
SCHEMBL7290720 0.73 MMP2 (0.58) ALDH1A1MMP2MMP9MAPT
SCHEMBL6663128 0.72 ECE1 (0.37) CA1CA2ALDH1A1
SCHEMBL8091782 0.72 ITGB3 (0.42) CA2TGFBR1ITGB3ITGA2B
SCHEMBL30447725 0.71 CA2 (0.42) CA1CA2ALDH1A1MMP2MMP9

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-20030171368-A1 Pyrimidinonesulfamoylureas` SEITZ WERNER (DE) 2003-09-11 US disclosed
WO-2003066624-A1 PYRIMIDINONESULFAMOYLUREAS AS INTEGRIN LIGANDS ABBOTT GMBH & CO. KG (DE) 2003-08-14 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-20030171368-A1 Pyrimidinonesulfamoylureas` ITGB1, ITGA1, ITGAM CA1 4517/4885CA2 4254/4885TGFBR1 397/4885

“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.