SCHEMBL5376492

SCHEMBL5376492

CN(C)C(=O)n1cnc(S(=O)(=O)CC2CCCCC2)n1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 2/20 0.42
KAT7 O95251 2/20 0.33
ALDH1A1 P00352 1/20 0.32
KAT8 Q9H7Z6 1/20 0.32
JAK2 O60674 1/20 0.31
JAK1 P23458 1/20 0.31
TYK2 P29597 1/20 0.31
JAK3 P52333 1/20 0.31
POLB P06746 1/20 0.31
BCHE P06276 1/20 0.31
SCN9A Q15858 2/20 0.31
AKT1 P31749 1/20 0.31
PIK3CA P42336 1/20 0.31
GPR119 Q8TDV5 1/20 0.31
HTR1A P08908 1/20 0.31
KCNH2 Q12809 1/20 0.31
S1PR1 P21453 2/20 0.30
S1PR3 Q99500 2/20 0.30
TSHR P16473 1/20 0.30
XBP1 P17861 1/20 0.30

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
SCHEMBL9320901 0.89 DPP4 (0.41) DPP4KAT7ALDH1A1KAT8POLB
SCHEMBL9320225 0.89 DPP4 (0.41) DPP4KAT7ALDH1A1KAT8POLB
SCHEMBL9320879 0.88 DPP4 (0.42) DPP4KAT7ALDH1A1POLBS1PR1
SCHEMBL9320182 0.85 DPP4 (0.35) DPP4
SCHEMBL9320192 0.85 DPP4 (0.42) DPP4ALDH1A1KAT8POLBS1PR1
SCHEMBL9321678 0.82 DPP4 (0.58) DPP4
SCHEMBL9320911 0.82 DPP4 (0.43) DPP4ALDH1A1JAK2JAK1JAK3
SCHEMBL5384535 0.81 DPP4 (0.50) DPP4KAT8S1PR3
SCHEMBL9320844 0.79 DPP4 (0.33) DPP4
SCHEMBL5384749 0.77 DPP4 (0.40) DPP4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7238720-B2 Pharmaceutical use of N-carbamoylazole derivatives EISAI R & D MANAGEMENT CO. LTD. (JP) 2007-07-03 US disclosed
US-7238720-B2 Pharmaceutical use of N-carbamoylazole derivatives EISAI R & D MANAGEMENT CO. LTD. (JP) 2007-07-03 US disclosed
EP-1258480-B1 Pharmaceutical use of N-Carbamoylazole derivatives EISAI CO LTD (JP) 2004-11-10 EP disclosed
EP-1258480-B1 Pharmaceutical use of N-Carbamoylazole derivatives EISAI CO LTD (JP) 2004-11-10 EP disclosed
US-20040186153-A1 Pharmaceutical use of N-carbamoylazole derivatives EISAI R & D MANAGEMENT CO. LTD. (JP) 2004-09-23 US disclosed
US-20030060494-A1 Pharmaceutical use of N-carbamoylazole derivatives EISAI CO., LTD. (JP) 2003-03-27 US disclosed
EP-1258480-A1 Pharmaceutical use of N-Carbamoylazole derivatives Eisai Co., Ltd. (JP) 2002-11-20 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 (2 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-20040186153-A1 Pharmaceutical use of N-carbamoylazole derivatives DPP4, DPP3, DPP7 DPP4 1/4885KAT7 2367/4885ALDH1A1 1026/4885
US-20030060494-A1 Pharmaceutical use of N-carbamoylazole derivatives DPP4, DPP3, DPP7 DPP4 1/4885KAT7 2367/4885ALDH1A1 1026/4885

“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.