SCHEMBL6509089

SCHEMBL6509089

CN(C)S(=O)(=O)c1ccc(NCC(C)(C)N)nc1

nearest known ligand 0.49

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HPGD P15428 2/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
ALDH1A1 P00352 4/20 0.48
LMNA P02545 3/20 0.48
KDM4E B2RXH2 6/20 0.48
MAPT P10636 5/20 0.48
MEN1 O00255 3/20 0.48
KMT2A Q03164 3/20 0.48
GAA P10253 3/20 0.48
TDP1 Q9NUW8 1/20 0.48
TP53 P04637 1/20 0.45
NPC1 O15118 2/20 0.43
HSD17B10 Q99714 1/20 0.39
RAB9A P51151 2/20 0.36
TSHR P16473 1/20 0.36
HTT P42858 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
SCHEMBL6698781 0.85 HPGD (0.43) HPGDSMN1; SMN2ALDH1A1LMNAKDM4E
SCHEMBL6703875 0.85 HPGD (0.43) HPGDSMN1; SMN2ALDH1A1LMNAKDM4E
SCHEMBL6701251 0.84 KDM4E (0.44) HPGDSMN1; SMN2ALDH1A1LMNAKDM4E
SCHEMBL6702326 0.84 HPGD (0.43) HPGDSMN1; SMN2ALDH1A1LMNAKDM4E
SCHEMBL6703201 0.84 HPGD (0.43) HPGDSMN1; SMN2ALDH1A1LMNAKDM4E
SCHEMBL6702241 0.82 MAPT (0.46) HPGDSMN1; SMN2ALDH1A1LMNAKDM4E
SCHEMBL6698773 0.81 ALDH1A1 (0.44) HPGDSMN1; SMN2ALDH1A1LMNAKDM4E
SCHEMBL6699915 0.80 HPGD (0.58) HPGDSMN1; SMN2ALDH1A1LMNAKDM4E
SCHEMBL6695888 0.78 LMNA (0.50) SMN1; SMN2ALDH1A1LMNAKDM4EMAPT
SCHEMBL6700068 0.77 ALDH1A1 (0.43) HPGDSMN1; SMN2ALDH1A1LMNAGAA

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-2005037828-A1 NOVEL INHIBITORS OF DPP-IV, METHODS OF PREPARING THE SAME, AND PHARMACEUTICAL COMPOSITIONS CONTAINING THE SAME AS AN ACTIVE AGENT LG LIFE SCIENCES LTD. (KR) 2005-04-28 WO disclosed
US-20040180925-A1 Dipeptidylpeptidase-IV inhibitor KYOWA HAKKO KOGYO CO., LTD. (JP) 2004-09-16 US disclosed
EP-1354882-A1 DIPEPTIDYL PEPTIDASE IV INHIBITOR KYOWA HAKKO KOGYO CO., LTD. (JP) 2003-10-22 EP 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-20040180925-A1 Dipeptidylpeptidase-IV inhibitor DPP4, DPP3, DPP9 HPGD 2000/4885SMN1; SMN2 3810/4885ALDH1A1 925/4885

“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.