SCHEMBL3239889

SCHEMBL3239889

CC(C)(C)[Si](C)(C)O[C@H]1CNC[C@@H](N(C(=O)O)c2ccncc2N)C1

nearest known ligand 0.33

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.33
ALDH1A1 P00352 2/20 0.33
GLA P06280 1/20 0.33
GAA P10253 1/20 0.33
MEN1 O00255 1/20 0.33
KDM6B O15054 1/20 0.33
KDM4A O75164 1/20 0.33
MAPT P10636 1/20 0.33
THRB P10828 1/20 0.33
KMT2A Q03164 1/20 0.33
KDM4D Q6B0I6 1/20 0.33
KDM4C Q9H3R0 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
BUB1 O43683 1/20 0.30
SSTR4 P31391 2/20 0.30

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
SCHEMBL3239906 1.00 KDM4E (0.33) KDM4EALDH1A1GLAGAAMEN1
SCHEMBL1710246 0.91 NAMPT (0.31)
SCHEMBL1710400 0.85 KDM4E (0.39) KDM4EALDH1A1GLAGAAMEN1
SCHEMBL1710402 0.85 KDM4E (0.39) KDM4EALDH1A1GLAGAAMEN1
SCHEMBL3241523 0.85 SSTR4 (0.30) SSTR4
SCHEMBL1710272 0.83 KDM4E (0.31) KDM4EALDH1A1GLAGAAMEN1
SCHEMBL3232429 0.83 KDM4E (0.35) KDM4EALDH1A1GLAGAAMEN1
SCHEMBL3232441 0.83 KDM4E (0.35) KDM4EALDH1A1GLAGAAMEN1
SCHEMBL4439362 0.82 PIM2 (0.34)
SCHEMBL3243175 0.80 KDM4E (0.32) KDM4EALDH1A1GLAGAAMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2262802-A1 PIM KINASE INHIBITORS AND METHODS OF THEIR USE Novartis AG (CH) 2010-12-22 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-2009109576-A1 PIM KINASE INHIBITORS AND METHODS OF THEIR USE NOVARTIS AG (CH) 2009-09-11 WO disclosed
WO-2008106692-A1 PIM KINASE INHIBITORS AND METHODS OF THEIR USE NOVARTIS VACCINES AND DIAGNOSTICS, INC. (US) 2008-09-04 WO disclosed