SCHEMBL1710241

SCHEMBL1710241

CC(C)(C)OC(=O)N[C@@H]1C[C@H](NC(=O)O)CN(c2ccncc2[N+](=O)[O-])C1

nearest known ligand 0.37

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CKS1B P61024 1/20 0.37
SKP1 P63208 1/20 0.37
SKP2 Q13309 1/20 0.37
EIF2AK4 Q9P2K8 1/20 0.37
MAPT P10636 2/20 0.37
KDM4D Q6B0I6 6/20 0.36
KMT2A Q03164 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
JAK2 O60674 2/20 0.36
JAK1 P23458 2/20 0.36
PDE10A Q9Y233 1/20 0.35
KDM1A O60341 1/20 0.35
MAOB P27338 1/20 0.35
DRD2 P14416 1/20 0.35
EPHX2 P34913 1/20 0.35
DPP4 P27487 1/20 0.35
JAK3 P52333 1/20 0.35
BTK Q06187 1/20 0.35
KDM6A O15550 1/20 0.34

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
SCHEMBL15109516 0.96 EIF2AK4 (0.39) CKS1BSKP1SKP2EIF2AK4MAPT
SCHEMBL13456885 0.96 EIF2AK4 (0.39) CKS1BSKP1SKP2EIF2AK4MAPT
SCHEMBL30628501 0.90 EIF2AK4 (0.46) CKS1BSKP1SKP2EIF2AK4MAPT
SCHEMBL15932912 0.90 EIF2AK4 (0.46) CKS1BSKP1SKP2EIF2AK4MAPT
SCHEMBL15932914 0.90 EIF2AK4 (0.46) CKS1BSKP1SKP2EIF2AK4MAPT
SCHEMBL2832654 0.90 EIF2AK4 (0.46) CKS1BSKP1SKP2EIF2AK4MAPT
SCHEMBL2832651 0.90 EIF2AK4 (0.46) CKS1BSKP1SKP2EIF2AK4MAPT
SCHEMBL11912147 0.90 EIF2AK4 (0.46) CKS1BSKP1SKP2EIF2AK4MAPT
SCHEMBL11912154 0.90 EIF2AK4 (0.46) CKS1BSKP1SKP2EIF2AK4MAPT
SCHEMBL4132725 0.90 DRD2 (0.37) CKS1BSKP1SKP2EIF2AK4MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140249135-A1 PIM KINASE INHIBITORS AND METHODS OF THEIR USE NOVARTIS AG (CH) 2014-09-04 US disclosed
US-8822497-B2 PIM kinase inhibitors and methods of their use NOVARTIS AG (CH) 2014-09-02 US disclosed
US-8759338-B2 Heterocyclic kinase inhibitors NOVARTIS AG (CH) 2014-06-24 US disclosed
EP-2344473-B1 HETEROCYCLIC PIM-KINASE INHIBITORS NOVARTIS AG (CH) 2014-04-16 EP disclosed
EP-2132177-B1 PIM KINASE INHIBITORS AND METHODS OF THEIR USE NOVARTIS AG (CH) 2013-07-17 EP disclosed
US-20120208815-A1 PIM KINASE INHIBITORS AND METHODS OF THEIR USE NOVARTIS AG (CH) 2012-08-16 US disclosed
US-20110195956-A1 Heterocyclic Kinase Inhibitors NOVARTIS AG (CH) 2011-08-11 US disclosed
EP-2344473-A1 HETEROCYCLIC PIM-KINASE INHIBITORS Novartis AG (CH) 2011-07-20 EP disclosed
WO-2010026122-A1 HETEROCYCLIC PIM-KINASE INHIBITORS NOVARTIS AG (CH) 2010-03-11 WO disclosed
EP-2132177-A1 PIM KINASE INHIBITORS AND METHODS OF THEIR USE Novartis Ag (CH) 2009-12-16 EP disclosed
WO-2008106692-A1 PIM KINASE INHIBITORS AND METHODS OF THEIR USE NOVARTIS VACCINES AND DIAGNOSTICS, INC. (US) 2008-09-04 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 (3 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-20140249135-A1 PIM KINASE INHIBITORS AND METHODS OF THEIR USE PIM1, PIM2, PIM3 CKS1B 178/4885SKP1 637/4885SKP2 73/4885
US-20120208815-A1 PIM KINASE INHIBITORS AND METHODS OF THEIR USE PIM1, PIM2, PIM3 CKS1B 178/4885SKP1 637/4885SKP2 73/4885
US-20110195956-A1 Heterocyclic Kinase Inhibitors PIM1, PIM2, PIM3 CKS1B 116/4885SKP1 402/4885SKP2 55/4885

“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.