SCHEMBL13833280

SCHEMBL13833280

CC(C)(C)OC(=O)N[C@H]1CCCN(c2cnccc2N)C1

nearest known ligand 0.55

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAP4K4 O95819 2/20 0.55
BTK Q06187 5/20 0.52
JAK3 P52333 3/20 0.52
AURKA O14965 3/20 0.49
PDPK1 O15530 3/20 0.49
AURKB Q96GD4 3/20 0.49
PDE10A Q9Y233 1/20 0.48
LCK P06239 2/20 0.47
EGFR P00533 1/20 0.47
CA1 P00915 1/20 0.47
CA2 P00918 1/20 0.47
SYK P43405 1/20 0.45
PIM1 P11309 1/20 0.44
PIM3 Q86V86 1/20 0.44
PIM2 Q9P1W9 1/20 0.44
KDM4D Q6B0I6 2/20 0.44
ALOX5AP P20292 1/20 0.43
FEN1 P39748 1/20 0.43
F10 P00742 1/20 0.43

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
SCHEMBL4564058 1.00 MAP4K4 (0.55) MAP4K4BTKJAK3AURKAPDPK1
SCHEMBL1710231 0.93 MAP4K4 (0.57) MAP4K4BTKJAK3AURKAPDPK1
SCHEMBL1710581 0.93 MAP4K4 (0.57) MAP4K4BTKJAK3AURKAPDPK1
SCHEMBL1710229 0.93 MAP4K4 (0.57) MAP4K4BTKJAK3AURKAPDPK1
SCHEMBL27796432 0.91 MAP4K4 (0.47) MAP4K4BTKJAK3AURKAPDPK1
SCHEMBL23497661 0.87 BTK (0.49) MAP4K4BTKJAK3AURKAPDPK1
SCHEMBL13156590 0.86 MAP4K4 (0.49) MAP4K4BTKJAK3PDE10ASYK
SCHEMBL1710216 0.86 MAP4K4 (0.49) MAP4K4BTKJAK3PDE10ASYK
SCHEMBL1710218 0.86 MAP4K4 (0.49) MAP4K4BTKJAK3PDE10ASYK
SCHEMBL13156648 0.86 MAP4K4 (0.56) MAP4K4BTKJAK3AURKAPDPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9187486-B2 Bicyclic pyridazine compounds as Pim inhibitors AMGEN INC. (US) 2015-11-17 US disclosed
US-20140221344-A1 Bicyclic Pyridazine Compounds as PIM Inhibitors AMGEN INC. 2014-08-07 US disclosed
WO-2012148775-A1 BICYCLIC PYRIDAZINE COMPOUNDS AS PIM INHIBITORS AMGEN INC. (US) 2012-11-01 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 (1 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-20140221344-A1 Bicyclic Pyridazine Compounds as PIM Inhibitors PIM1, PIM2, PIM3 MAP4K4 255/4885BTK 95/4885JAK3 75/4885

“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.