SCHEMBL4444769

SCHEMBL4444769

CC(C)(C)[Si](C)(C)O[C@H]1CNC[C@@H](N(C(=O)O)c2ccncc2NC(=O)c2ccc(F)c(Br)n2)C1

nearest known ligand 0.35

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PIM1 P11309 19/20 0.35
PIM3 Q86V86 18/20 0.35
PIM2 Q9P1W9 18/20 0.35
GSK3B P49841 1/20 0.34
PRKCQ Q04759 1/20 0.34
KCNH2 Q12809 1/20 0.34
PKN1 Q16512 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
SCHEMBL12495335 0.85 PIM1 (0.36) PIM1PIM3PIM2
SCHEMBL4437200 0.83 PIM1 (0.38) PIM1PIM3PIM2
SCHEMBL4439362 0.82 PIM2 (0.34) PIM1PIM3PIM2
SCHEMBL3239889 0.77 KDM4E (0.33)
SCHEMBL3239906 0.77 KDM4E (0.33)
SCHEMBL4438027 0.76 PIM1 (0.40) PIM1PIM3PIM2
SCHEMBL15103573 0.75 PIM1 (0.39) PIM1PIM3PIM2
SCHEMBL3241523 0.74 SSTR4 (0.30)
SCHEMBL11908632 0.74 PIM1 (0.46) PIM1PIM3PIM2
SCHEMBL17440459 0.73 PIM1 (0.43) PIM1PIM3PIM2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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