SCHEMBL1521358

SCHEMBL1521358

CC(=O)N[C@H](CCCNC(=N)N)C(=O)NCC(=O)NC[C]=O

nearest known ligand 0.43

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SIRT6 Q8N6T7 1/20 0.43
SIRT1 Q96EB6 1/20 0.43
SIRT5 Q9NXA8 2/20 0.38
NPY4R P50391 12/20 0.37
NPY1R P25929 9/20 0.37
NPY5R Q15761 8/20 0.37
NPY2R P49146 5/20 0.37
ALB P02768 1/20 0.34
CA1 P00915 2/20 0.34
CA2 P00918 2/20 0.34
IL23R Q5VWK5 1/20 0.33

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
SCHEMBL1521603 0.99 SIRT6 (0.43) SIRT6SIRT1SIRT5NPY4RNPY1R
SCHEMBL1521788 0.91 SIRT6 (0.48) SIRT6SIRT1SIRT5NPY4RNPY1R
SCHEMBL19791245 0.84 SIRT6 (0.44) SIRT6SIRT1SIRT5NPY4RNPY1R
SCHEMBL1521599 0.82 DPP7 (0.43) NPY4RNPY1RNPY5RNPY2R
SCHEMBL22106685 0.82 SIRT6 (0.47) SIRT6SIRT1SIRT5NPY4RNPY1R
SCHEMBL22334062 0.82 SIRT6 (0.47) SIRT6SIRT1SIRT5NPY4RNPY1R
SCHEMBL26653399 0.82 SIRT6 (0.47) SIRT6SIRT1SIRT5NPY4RNPY1R
SCHEMBL2184148 0.82 DPP7 (0.43) NPY4RNPY1RNPY5RNPY2R
SCHEMBL19975767 0.82 SIRT6 (0.48) SIRT6SIRT1SIRT5NPY4RNPY1R
SCHEMBL4284356 0.81 SIRT6 (0.53) SIRT6SIRT1SIRT5NPY4RNPY1R

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8778871-B2 Metastin derivatives and use thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2014-07-15 US disclosed
US-8765909-B2 Metastin derivatives and use thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2014-07-01 US disclosed
US-20110312898-A1 PROPHYLACTIC / THERAPEUTIC AGENT FOR CANCER TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2011-12-22 US disclosed
EP-2379053-A1 PROPHYLACTIC/THERAPEUTIC AGENT FOR CANCER Takeda Pharmaceutical Company Limited (JP) 2011-10-26 EP disclosed
US-20110059888-A1 METASTIN DERIVATIVES AND USE THEREOF TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2011-03-10 US disclosed
US-7786083-B2 Metastin derivatives and use thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-08-31 US disclosed
WO-2010076896-A1 PROPHYLACTIC/THERAPEUTIC AGENT FOR CANCER TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-07-08 WO disclosed
US-20090298765-A1 Metastin derivatives and use thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-12-03 US disclosed
US-7625869-B2 Metastin derivatives and use thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-12-01 US disclosed
EP-2113513-A2 Metastin derivatives and use thereof Takeda Pharmaceutical Company Limited (JP) 2009-11-04 EP disclosed
US-20090215700-A1 Metastin derivatives and use thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-08-27 US disclosed
EP-2081955-A1 METASTIN DERIVATIVES AND USE THEREOF Takeda Pharmaceutical Company Limited (JP) 2009-07-29 EP disclosed
US-20080312155-A1 Metastin Derivatives and Use Thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2008-12-18 US disclosed
WO-2008050897-A1 METASTIN DERIVATIVES AND USE THEREOF TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2008-05-02 WO disclosed
EP-1758932-A2 METASTIN DERIVATIVES AND USE THEREOF Takeda Pharmaceutical Company Limited (JP) 2007-03-07 EP disclosed
WO-2006001499-A2 METASTIN DERIVATIVES AND USE THEREOF TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2006-01-05 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 (5 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-20090215700-A1 Metastin derivatives and use thereof SHBG, GNRHR, INHA SIRT6 1725/4885SIRT1 999/4885SIRT5 1876/4885
US-20080312155-A1 Metastin Derivatives and Use Thereof GNRHR, SHBG, MEN1 SIRT6 940/4885SIRT1 480/4885SIRT5 1086/4885
US-20110312898-A1 PROPHYLACTIC / THERAPEUTIC AGENT FOR CANCER KLK3, SHBG, SERPINA3 SIRT6 708/4885SIRT1 217/4885SIRT5 757/4885
US-20110059888-A1 METASTIN DERIVATIVES AND USE THEREOF SHBG, GNRHR, INHA SIRT6 1725/4885SIRT1 999/4885SIRT5 1876/4885
US-20090298765-A1 Metastin derivatives and use thereof GNRHR, SHBG, MEN1 SIRT6 940/4885SIRT1 480/4885SIRT5 1086/4885

“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.