SCHEMBL2539145

SCHEMBL2539145

CN(CCNC(=O)C(N)CCCCNC(=O)OC(C)(C)C)C(=O)OCc1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.50
ANPEP P15144 1/20 0.50
DPP8 Q6V1X1 2/20 0.47
DPP7 Q9UHL4 2/20 0.47
DPP4 P27487 1/20 0.47
DPP9 Q86TI2 1/20 0.47
FOLH1 Q04609 2/20 0.46
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
TPSAB1 Q15661 2/20 0.44
TPSD1 Q9BZJ3 2/20 0.44
TPSG1 Q9NRR2 2/20 0.44
SYK P43405 1/20 0.44
KLK7 P49862 2/20 0.44
KLK5 Q9Y337 2/20 0.44
L3MBTL1 Q9Y468 1/20 0.44

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
SCHEMBL1328863 1.00 MAPT (0.50) MAPTANPEPDPP8DPP7DPP4
SCHEMBL2562513 0.90 MAPT (0.49) MAPTANPEPDPP8DPP7DPP4
SCHEMBL10242708 0.88 KLK7 (0.54) MAPTMEN1KMT2AKLK7KLK5
SCHEMBL12127588 0.86 CA1 (0.55) MAPTMEN1KMT2AKLK7KLK5
SCHEMBL29229822 0.86 SYK (0.53) MAPTFOLH1SYKL3MBTL1
SCHEMBL12287162 0.84 KLK7 (0.49) MAPTMEN1KMT2AKLK7KLK5
SCHEMBL2584353 0.84 KLK7 (0.49) MAPTMEN1KMT2AKLK7KLK5
SCHEMBL13851530 0.84 SYK (0.51) MAPTFOLH1MEN1KMT2ASYK
SCHEMBL18879557 0.84 ANPEP (0.52) MAPTANPEPDPP8DPP7DPP4
SCHEMBL5490556 0.83 MAPT (0.59) MAPTANPEPDPP8DPP7DPP4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2560489-A1 COMPOSITIONS COMPRISING ENZYME-CLEAVABLE OPIOID PRODRUGS AND INHIBITORS THEREOF Signature Therapeutics, Inc. (US) 2013-02-27 EP disclosed
EP-2560490-A1 COMPOSITIONS COMPRISING ENZYME-CLEAVABLE PRODRUGS OF ACTIVE AGENTS AND INHIBITORS THEREOF Signature Therapeutics, Inc. (US) 2013-02-27 EP disclosed
WO-2011133151-A1 COMPOSITIONS COMPRISING ENZYME-CLEAVABLE PHENOL-MODIFIED OPIOID PRODRUGS AND INHIBITORS THEREOF PHARMACOFORE, INC. (US) 2011-10-27 WO disclosed
WO-2011133149-A1 COMPOSITIONS COMPRISING ENZYME-CLEAVABLE OPIOID PRODRUGS AND INHIBITORS THEREOF PHARMACOFORE, INC. (US) 2011-10-27 WO disclosed
WO-2011133150-A1 COMPOSITIONS COMPRISING ENZYME-CLEAVABLE PRODRUGS OF ACTIVE AGENTS AND INHIBITORS THEREOF PHARMACOFORE, INC. (US) 2011-10-27 WO disclosed
US-20110262359-A1 COMPOSITIONS COMPRISING ENZYME-CLEAVABLE PRODRUGS OF ACTIVE AGENTS AND INHIBITORS THEREOF SIGNATURE THERAPEUTICS, INC. 2011-10-27 US 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-20110262359-A1 COMPOSITIONS COMPRISING ENZYME-CLEAVABLE PRODRUGS OF ACTIVE AGENTS AND INHIBITORS THEREOF PEPD, TMPRSS15, ADAM17 MAPT 2944/4885ANPEP 31/4885DPP8 46/4885

“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.