SCHEMBL4437552

SCHEMBL4437552

CC(C)(C)OC(=O)N(c1ccc(Cl)cc1N)C1CCCNC1

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 11/20 0.39
SLC6A4 P31645 11/20 0.39
KDM4E B2RXH2 2/20 0.39
ALDH1A1 P00352 2/20 0.39
KMT2A Q03164 2/20 0.39
MEN1 O00255 1/20 0.39
RAB9A P51151 1/20 0.39
SLC6A3 Q01959 3/20 0.39
NOS1 P29475 4/20 0.39
NOS2 P35228 4/20 0.39
NOS3 P29474 1/20 0.39
KCNH2 Q12809 2/20 0.36
CYP2D6 P10635 1/20 0.36
AHCY P23526 1/20 0.36
PAK4 O96013 1/20 0.35
GAA P10253 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
SCHEMBL4443673 0.88 RPLP1 (0.34) SLC6A2SLC6A4SLC6A3KCNH2CYP2D6
SCHEMBL4444981 0.87 SLC6A4 (0.40) SLC6A2SLC6A4KDM4EALDH1A1KMT2A
SCHEMBL4445222 0.87 RPLP1 (0.40) KDM4EALDH1A1KMT2AMEN1KCNH2
SCHEMBL4433912 0.87 FLT3 (0.35) SLC6A2SLC6A4SLC6A3KCNH2GAA
SCHEMBL4431999 0.85 MEN1 (0.34) SLC6A2SLC6A4KMT2AMEN1SLC6A3
SCHEMBL4434895 0.84 MAPK1 (0.37) SLC6A2SLC6A4ALDH1A1KMT2AMEN1
SCHEMBL4438021 0.83 KCNH2 (0.37) SLC6A2SLC6A4KMT2AMEN1SLC6A3
SCHEMBL4434418 0.82 RPLP1 (0.34) SLC6A2SLC6A4SLC6A3KCNH2CYP2D6
SCHEMBL3410670 0.81 RPLP1 (0.36) KCNH2
SCHEMBL4436048 0.81 RPLP1 (0.36) KCNH2

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