SCHEMBL5592291

SCHEMBL5592291

CCOc1ccc(N2CCNC(Cc3ccccc3N3CCN(C)CC3)C2=O)cn1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BRD9 Q9H8M2 9/20 0.38
BRD4 O60885 4/20 0.38
BRPF1 P55201 3/20 0.38
BRD7 Q9NPI1 2/20 0.36
SLC6A2 P23975 3/20 0.35
SLC6A4 P31645 3/20 0.35
SLC6A3 Q01959 3/20 0.35
HTR1A P08908 2/20 0.35
KDM1A O60341 1/20 0.35
TNK2 Q07912 2/20 0.35
DRD2 P14416 1/20 0.34
DRD4 P21917 1/20 0.34
HTR2A P28223 1/20 0.34
HTR2C P28335 1/20 0.34
DRD3 P35462 1/20 0.34
NCF1 P14598 1/20 0.34
DCLK1 O15075 1/20 0.34
MAPK7 Q13164 1/20 0.34
LRRK2 Q5S007 1/20 0.34
MEN1 O00255 1/20 0.33

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
SCHEMBL5592285 0.88 ELANE (0.35) SLC6A2SLC6A4SLC6A3KDM1ATNK2
SCHEMBL5592317 0.86 ALDH1A1 (0.37) HTR1ATNK2DRD2HTR2A
SCHEMBL5592389 0.79 DRD2 (0.39) BRD9BRD4BRPF1BRD7SLC6A2
SCHEMBL5599213 0.79 SLC6A2 (0.40) BRD9BRD4BRPF1BRD7SLC6A2
SCHEMBL5592325 0.76 NCF1 (0.36) BRD9BRD4BRPF1BRD7SLC6A2
SCHEMBL5592318 0.76 MEN1 (0.36) BRD9BRD4BRPF1BRD7SLC6A2
SCHEMBL5592174 0.74 SLC6A2 (0.35) BRD9BRD4BRPF1SLC6A2SLC6A4
SCHEMBL5808001 0.73 ACACB (0.34) KDM1ATNK2HTR2CMEN1KMT2A
SCHEMBL1737840 0.71 WDR5 (0.40) BRD9BRD4BRPF1BRD7
SCHEMBL5606425 0.71 WDR5 (0.40) BRD9BRD4BRPF1BRD7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2007057742-A2 NOVEL PIPERAZINONE DERIVATIVES PFIZER PRODUCTS INC. (US) 2007-05-24 WO disclosed