SCHEMBL4120488

SCHEMBL4120488

CC(C)(C)OC(=O)N[C@@H]1CN(c2ccncc2N)CC[C@H]1O[Si](C)(C)C(C)(C)C

nearest known ligand 0.37

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
EIF2AK4 Q9P2K8 1/20 0.37
MAP4K4 O95819 2/20 0.37
CKS1B P61024 1/20 0.36
SKP1 P63208 1/20 0.36
SKP2 Q13309 1/20 0.36
KDM4D Q6B0I6 8/20 0.35
MAPT P10636 1/20 0.35
GPR119 Q8TDV5 2/20 0.35
PIM1 P11309 1/20 0.35
PIM3 Q86V86 1/20 0.35
PIM2 Q9P1W9 1/20 0.35
PDE10A Q9Y233 1/20 0.34
HDAC3 O15379 1/20 0.34
HDAC1 Q13547 1/20 0.34
HDAC2 Q92769 1/20 0.34
KDM6A O15550 1/20 0.34
DRD2 P14416 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
SCHEMBL3433583 1.00 EIF2AK4 (0.37) EIF2AK4MAP4K4CKS1BSKP1SKP2
SCHEMBL11978261 0.94 RET (0.37) EIF2AK4MAP4K4CKS1BSKP1SKP2
SCHEMBL11898914 0.91 MAPT (0.36) MAPTGPR119PIM1PIM3PIM2
SCHEMBL4433671 0.91 MAPT (0.36) MAPTGPR119PIM1PIM3PIM2
SCHEMBL1710280 0.91 MAPT (0.36) MAPTGPR119PIM1PIM3PIM2
SCHEMBL13707585 0.86 EIF2AK4 (0.40) EIF2AK4MAP4K4CKS1BSKP1SKP2
SCHEMBL13456795 0.86 EIF2AK4 (0.40) EIF2AK4MAP4K4CKS1BSKP1SKP2
SCHEMBL4118695 0.86 MAPT (0.38) EIF2AK4CKS1BSKP1SKP2KDM4D
SCHEMBL4132594 0.86 MAPT (0.38) EIF2AK4CKS1BSKP1SKP2KDM4D
SCHEMBL30628534 0.85 MAP4K4 (0.35) EIF2AK4MAP4K4KDM4DMAPTPIM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8829193-B2 PIM kinase inhibitors and methods of their use NOVARTIS AG (CH) 2014-09-09 US disclosed
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
US-20120208815-A1 PIM KINASE INHIBITORS AND METHODS OF THEIR USE NOVARTIS AG (CH) 2012-08-16 US disclosed
US-20120202851-A1 PIM KINASE INHIBITORS AND METHODS OF THEIR USE NOVARTIS AG (CH) 2012-08-09 US disclosed
US-8168794-B2 Pim kinase inhibitors and methods of their use NOVARTIS AG (CH) 2012-05-01 US disclosed
US-20110195956-A1 Heterocyclic Kinase Inhibitors NOVARTIS AG (CH) 2011-08-11 US disclosed
US-20100216839-A1 Pim kinase inhibitors and methods of their use NOVARTIS AG (CH) 2010-08-26 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-20100216839-A1 Pim kinase inhibitors and methods of their use PIM1, PIM2, PIM3 EIF2AK4 368/4885MAP4K4 50/4885CKS1B 216/4885
US-20140249135-A1 PIM KINASE INHIBITORS AND METHODS OF THEIR USE PIM1, PIM2, PIM3 EIF2AK4 401/4885MAP4K4 85/4885CKS1B 178/4885
US-20120202851-A1 PIM KINASE INHIBITORS AND METHODS OF THEIR USE PIM1, PIM2, PIM3 EIF2AK4 368/4885MAP4K4 50/4885CKS1B 216/4885
US-20120208815-A1 PIM KINASE INHIBITORS AND METHODS OF THEIR USE PIM1, PIM2, PIM3 EIF2AK4 401/4885MAP4K4 85/4885CKS1B 178/4885
US-20110195956-A1 Heterocyclic Kinase Inhibitors PIM1, PIM2, PIM3 EIF2AK4 512/4885MAP4K4 105/4885CKS1B 116/4885

“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.