SCHEMBL4529623

SCHEMBL4529623

C[C@H]([C]=O)NC(=O)[C@@H](C)N

nearest known ligand 0.50

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 4/20 0.50
DPP8 Q6V1X1 2/20 0.39
DPP7 Q9UHL4 2/20 0.39
PAX8 Q06710 1/20 0.38
CTRB1 P17538 5/20 0.37
SLC15A1 P46059 1/20 0.34
FAP Q12884 1/20 0.33
DPP9 Q86TI2 1/20 0.33
TAAR1 Q96RJ0 1/20 0.32
XIAP P98170 1/20 0.31
BIRC2 Q13490 1/20 0.31
NOD1 Q9Y239 1/20 0.30
IDO1 P14902 2/20 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
SCHEMBL1036160 1.00 DPP4 (0.50) DPP4DPP8DPP7PAX8CTRB1
SCHEMBL1036159 1.00 DPP4 (0.50) DPP4DPP8DPP7PAX8CTRB1
SCHEMBL1521317 0.92 DPP4 (0.44) DPP4DPP8DPP7PAX8CTRB1
SCHEMBL1521228 0.92 DPP4 (0.44) DPP4DPP8DPP7PAX8CTRB1
SCHEMBL1521315 0.92 DPP4 (0.44) DPP4DPP8DPP7PAX8CTRB1
SCHEMBL1521233 0.92 DPP4 (0.44) DPP4DPP8DPP7PAX8CTRB1
SCHEMBL8586463 0.87 DPP4 (0.40) DPP4DPP8DPP7PAX8CTRB1
SCHEMBL8586461 0.87 DPP4 (0.40) DPP4DPP8DPP7PAX8CTRB1
SCHEMBL1034774 0.82 DPP4 (0.53) DPP4DPP8DPP7FAPDPP9
SCHEMBL1034776 0.82 DPP4 (0.53) DPP4DPP8DPP7FAPDPP9

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 33 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2004031142-A2 INHIBITION OF METALLO-BETA-LACTAMASE TEXAS TECH UNIVERSITY SYSTEM (US) 2004-04-15 WO claimed
US-20240139282-A1 LIQUID DALBAVANCIN COMPOSITIONS HIKMA PHARMACEUTICALS USA INC. 2024-05-02 US disclosed
WO-2024079224-A1 LIQUID DALBAVANCIN COMPOSITION XELLIA PHARMACEUTICALS APS (DK) 2024-04-18 WO disclosed
WO-2024079223-A1 LIQUID DALBAVANCIN COMPOSITION XELLIA PHARMACEUTICALS APS (DK) 2024-04-18 WO disclosed
US-20240083950-A1 SYNTHESIS PROCESS XELLIA PHARMACEUTICALS APS (DK) 2024-03-14 US disclosed
EP-4274842-A1 SYNTHESIS PROCESS Xellia Pharmaceuticals ApS (DK) 2023-11-15 EP disclosed
CN-116710470-A Synthesis method 埃克斯利亚制药有限公司 2023-09-05 CN disclosed
WO-2022148868-A1 SYNTHESIS PROCESS XELLIA PHARMACEUTICALS APS (DK) 2022-07-14 WO disclosed
CN-104807760-A Universal type multi-signal output biosensor, as well as preparation method and application thereof UNIV LUDONG 2015-07-29 CN disclosed
US-20090203003-A1 INHIBITION OF METALLO-BETA-LACTAMASE TEXAS TECH UNIVERSITY SYSTEM (US) 2009-08-13 US disclosed
US-4560508-A BETA-LACTAMASE INHIBITORS, ANINICROBIAL AGENT, CHEMICAL INTERMEDIATE TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1985-12-24 US disclosed
US-4550105-A BETA-LACTAMASE INHIBITORS, ANTIBIOTICS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1985-10-29 US disclosed
EP-0021678-B1 1-SULPHO-2-OXOAZETIDINE DERIVATIVES, THEIR PRODUCTION AND PHARMACEUTICAL COMPOSITIONS THEREOF Takeda Chemical Industries, Ltd. (JP) 1984-11-07 EP disclosed
EP-0095764-A2 2-Oxoazetidinone derivatives, their production and use Takeda Chemical Industries, Ltd. (JP) 1983-12-07 EP disclosed
US-4416817-A BACTERICIDES TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1983-11-22 US disclosed
EP-0083039-A1 4-Cyano-2-azetidinones and production thereof Takeda Chemical Industries, Ltd. (JP) 1983-07-06 EP disclosed
EP-0053815-A1 2-Oxoazetidine derivatives, their production and use Takeda Chemical Industries, Ltd. (JP) 1982-06-16 EP disclosed
EP-0053387-A1 Method of preparing 1-sulfo-2-oxoazetidine derivatives and intermediates therefor Takeda Chemical Industries, Ltd. (JP) 1982-06-09 EP disclosed
EP-0021676-A1 3-Methoxy-2-oxoazetidine derivatives and their production Takeda Chemical Industries, Ltd. (JP) 1981-01-07 EP disclosed
EP-0021678-A1 1-Sulpho-2-oxoazetidine derivatives, their production and pharmaceutical compositions thereof Takeda Chemical Industries, Ltd. (JP) 1981-01-07 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-20240139282-A1 LIQUID DALBAVANCIN COMPOSITIONS STT3B, DDOST, KRTCAP2 DPP4 590/4885DPP8 1223/4885DPP7 759/4885
US-20240083950-A1 SYNTHESIS PROCESS AS3MT, O60361, TPD52L2 DPP4 271/4885DPP8 604/4885DPP7 823/4885

“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.