SCHEMBL608998

SCHEMBL608998

CC(=O)NCCCCCC(=O)N[C@@H](CCCNC(=N)N[N+](=O)[O-])C(=O)N[CH]CC(C)C

nearest known ligand 0.36

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
NPY4R P50391 7/20 0.36
NPY5R Q15761 6/20 0.36
NPY1R P25929 5/20 0.36
NPY2R P49146 3/20 0.36
NMT2 O60551 1/20 0.35
NMT1 P30419 1/20 0.35
FOLH1 Q04609 1/20 0.32
SIRT5 Q9NXA8 1/20 0.31
LPAR3 Q9UBY5 2/20 0.31
ADRA1A P35348 1/20 0.31
GLP1R P43220 3/20 0.31
SIRT6 Q8N6T7 1/20 0.31
SIRT1 Q96EB6 1/20 0.31
FNTA P49354 1/20 0.31
FNTB P49356 1/20 0.31

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
SCHEMBL607297 0.96 NPY4R (0.33) NPY4RNPY5RNPY1RNPY2RNMT2
SCHEMBL608638 0.94 NPY4R (0.36) NPY4RNPY5RNPY1RNPY2RNMT2
SCHEMBL607834 0.93 NPY4R (0.35) NPY4RNPY5RNPY1RNPY2RNMT2
SCHEMBL608040 0.92 NOD1 (0.39) NPY4RNPY5RNPY1RNPY2RNMT2
SCHEMBL608584 0.92 NOD1 (0.39) NPY4RNPY5RNPY1RNPY2RNMT2
SCHEMBL609495 0.92 NMT2 (0.38) NPY4RNPY5RNPY1RNPY2RNMT2
SCHEMBL605359 0.92 NOD1 (0.39) NPY4RNPY5RNPY1RNPY2RNMT2
SCHEMBL608326 0.92 NOD1 (0.39) NPY4RNPY5RNPY1RNPY2RNMT2
SCHEMBL606021 0.92 NOD1 (0.39) NPY4RNPY5RNPY1RNPY2RNMT2
SCHEMBL607616 0.92 NOD1 (0.39) NPY4RNPY5RNPY1RNPY2RNMT2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9233115-B2 Proteasome inhibitors and methods of using the same MILLENNIUM PHARMACEUTICALS INC. (US) 2016-01-12 US disclosed
US-20140088042-A1 Proteasome Inhibitors And Methods Of Using The Same CEPHALON, INC. (US) 2014-03-27 US disclosed
US-8546608-B2 Proteasome inhibitors and methods of using the same CEPHALON, INC. (US) 2013-10-01 US disclosed
US-20120041196-A1 Proteasome Inhibitors and Methods of Using the Same CEPHALON, INC. (US) 2012-02-16 US disclosed
US-7915236-B2 Proteasome inhibitors and methods of using the same CEPHALON, INC. (US) 2011-03-29 US disclosed
EP-1660507-B9 PROTEASOME INHIBITORS AND METHODS OF USING THE SAME CEPHALON INC (US) 2010-03-24 EP disclosed
US-20090291918-A1 PROTEASOME INHIBITORS AND METHODS OF USING THE SAME CEPHALON, INC. (US) 2009-11-26 US disclosed
US-7576206-B2 Proteasome inhibitors and methods of using the same CEPHALON, INC. (US) 2009-08-18 US disclosed
EP-1660507-B1 PROTEASOME INHIBITORS AND METHODS OF USING THE SAME CEPHALON INC (US) 2009-08-05 EP disclosed
EP-1658255-B1 PROTEASOME INHIBITORS AND METHODS OF USING THE SAME CEPHALON INC (US) 2009-02-18 EP disclosed
US-7223745-B2 Proteasome inhibitors and methods of using the same CEPHALON, INC. (US) 2007-05-29 US disclosed
US-20050107307-A1 Proteasome inhibitors and methods of using the same TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2005-05-19 US disclosed
US-20050059636-A1 Proteasome inhibitors and methods of using the same CEPHALON, INC. 2005-03-17 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 (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-20090291918-A1 PROTEASOME INHIBITORS AND METHODS OF USING THE SAME PSMB11, PSMB5, PSMB6 NPY4R 4558/4885NPY5R 4469/4885NPY1R 4623/4885
US-20120041196-A1 Proteasome Inhibitors and Methods of Using the Same PSMB11, PSMB5, PSMB6 NPY4R 4558/4885NPY5R 4469/4885NPY1R 4623/4885
US-20050107307-A1 Proteasome inhibitors and methods of using the same PSMB11, PSMB5, PSMB6 NPY4R 4558/4885NPY5R 4469/4885NPY1R 4623/4885
US-20140088042-A1 Proteasome Inhibitors And Methods Of Using The Same PSMB11, PSMB5, PSMB6 NPY4R 4558/4885NPY5R 4469/4885NPY1R 4623/4885
US-20050059636-A1 Proteasome inhibitors and methods of using the same PSMB11, PSMB5, PSMB6 NPY4R 4558/4885NPY5R 4469/4885NPY1R 4623/4885

“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.