SCHEMBL4351656

SCHEMBL4351656

O=CCCC1CC(=O)NC1=O

nearest known ligand 0.40

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MAP3K14 Q99558 1/20 0.40
GLA P06280 1/20 0.37
CRBN Q96SW2 6/20 0.33
DDB1 Q16531 3/20 0.33
FFAR1 O14842 1/20 0.32
CYP19A1 P11511 1/20 0.32
PDCD1LG2 Q9BQ51 1/20 0.31
CD274 Q9NZQ7 1/20 0.31
LMNA P02545 1/20 0.31
MAPT P10636 1/20 0.31
PKM P14618 1/20 0.31
HDAC8 Q9BY41 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
SCHEMBL28479332 0.82 MAP3K14 (0.50) MAP3K14GLACRBNDDB1FFAR1
SCHEMBL29956517 0.81 MAP3K14 (0.41) MAP3K14GLACRBNDDB1FFAR1
SCHEMBL29129779 0.78 MAP3K14 (0.46) MAP3K14GLACRBNDDB1FFAR1
SCHEMBL28520632 0.76 MAP3K14 (0.44) MAP3K14GLACRBNDDB1FFAR1
SCHEMBL3042782 0.75 FAAH (0.44) MAP3K14GLACRBNDDB1FFAR1
SCHEMBL23199745 0.74 MAP3K14 (0.43) MAP3K14GLACRBNDDB1FFAR1
SCHEMBL1536267 0.74 MAP3K14 (0.43) MAP3K14GLACRBNDDB1FFAR1
SCHEMBL1056468 0.74 MAP3K14 (0.43) MAP3K14GLACRBNDDB1FFAR1
SCHEMBL1838214 0.74 MAP3K14 (0.43) MAP3K14GLACRBNDDB1FFAR1
SCHEMBL10573688 0.73

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
JP-2009082129-A PROCESS FOR PREPARING CHIRAL COMPOUND PFIZER PROD INC 2009-04-23 JP disclosed