SCHEMBL2694052

SCHEMBL2694052

CC(C)(C)OC(=O)N[C@H]1C[C@H](OC(=O)c2ccccc2)CN(c2ccncc2N)C1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIM1 P11309 2/20 0.42
PIM3 Q86V86 2/20 0.42
PIM2 Q9P1W9 2/20 0.42
PDE10A Q9Y233 3/20 0.40
CKS1B P61024 1/20 0.38
SKP1 P63208 1/20 0.38
SKP2 Q13309 1/20 0.38
KMT2A Q03164 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
MAP4K4 O95819 2/20 0.37
BTK Q06187 3/20 0.37
KDM1A O60341 1/20 0.37
MAOB P27338 1/20 0.37
EIF2AK4 Q9P2K8 1/20 0.36
AURKA O14965 1/20 0.36
PDPK1 O15530 1/20 0.36
AURKB Q96GD4 1/20 0.36
EPHX2 P34913 1/20 0.36
BUB1 O43683 1/20 0.35
HTR3E A5X5Y0 1/20 0.35

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
SCHEMBL2694057 1.00 PIM1 (0.42) PIM1PIM3PIM2PDE10ACKS1B
SCHEMBL2694889 0.86 PIM1 (0.38) PIM1PIM3PIM2PDE10ACKS1B
SCHEMBL2694887 0.86 PIM1 (0.38) PIM1PIM3PIM2PDE10ACKS1B
SCHEMBL4132786 0.86 MAP4K4 (0.41) PIM1PIM3PIM2PDE10ACKS1B
SCHEMBL13457022 0.86 MAP4K4 (0.44) PDE10ACKS1BSKP1SKP2KMT2A
SCHEMBL15109521 0.86 MAP4K4 (0.44) PDE10ACKS1BSKP1SKP2KMT2A
SCHEMBL1710215 0.84 MAP4K4 (0.42) PDE10ACKS1BSKP1SKP2KMT2A
SCHEMBL4131470 0.84 PIM1 (0.40) PIM1PIM3PIM2PDE10ACKS1B
SCHEMBL4118784 0.83 MAP4K4 (0.39) PDE10ACKS1BSKP1SKP2MAP4K4
SCHEMBL2836325 0.82 EIF2AK4 (0.48) PIM1PIM3PIM2PDE10ACKS1B

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 12 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-8829193-B2 PIM kinase inhibitors and methods of their use NOVARTIS AG (CH) 2014-09-09 US disclosed
EP-2262802-B1 PIM KINASE INHIBITORS AND METHODS OF THEIR USE NOVARTIS AG (CH) 2013-10-23 EP disclosed
EP-2596790-A1 Pim kinase inhibitors and methods of their use Novartis AG (CH) 2013-05-29 EP 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-8168794-B2 Pim kinase inhibitors and methods of their use NOVARTIS AG (CH) 2012-05-01 US disclosed
EP-2262802-A1 PIM KINASE INHIBITORS AND METHODS OF THEIR USE Novartis AG (CH) 2010-12-22 EP disclosed
US-20100216839-A1 Pim kinase inhibitors and methods of their use NOVARTIS AG (CH) 2010-08-26 US disclosed
US-20100216839-A1 Pim kinase inhibitors and methods of their use NOVARTIS AG (CH) 2010-08-26 US disclosed
WO-2009109576-A1 PIM KINASE INHIBITORS AND METHODS OF THEIR USE NOVARTIS AG (CH) 2009-09-11 WO disclosed
WO-2009109576-A1 PIM KINASE INHIBITORS AND METHODS OF THEIR USE NOVARTIS AG (CH) 2009-09-11 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 (2 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 PIM1 1/4885PIM3 3/4885PIM2 2/4885
US-20120202851-A1 PIM KINASE INHIBITORS AND METHODS OF THEIR USE PIM1, PIM2, PIM3 PIM1 1/4885PIM3 3/4885PIM2 2/4885

“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.