SCHEMBL5253267

SCHEMBL5253267

CC1CN(C(=O)OC(C)(C)C)CCC1N1CCc2ccccc21

nearest known ligand 0.47

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PRMT5 O14744 4/20 0.47
WDR77 Q9BQA1 4/20 0.47
GPR119 Q8TDV5 2/20 0.46
USP30 Q70CQ3 6/20 0.44
NAMPT P43490 2/20 0.43
JAK2 O60674 1/20 0.42
JAK1 P23458 1/20 0.42
MAPK1 P28482 1/20 0.42
KDM4E B2RXH2 1/20 0.42
PKM P14618 1/20 0.42
SMARCA2 P51531 1/20 0.41
SMARCA4 P51532 1/20 0.41
PBRM1 Q86U86 1/20 0.41

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
SCHEMBL3940077 0.86 USP30 (0.49) PRMT5WDR77GPR119USP30NAMPT
SCHEMBL2707784 0.83 GPR119 (0.52) PRMT5WDR77GPR119NAMPTMAPK1
SCHEMBL2675407 0.80 USP30 (0.48) PRMT5WDR77GPR119USP30NAMPT
SCHEMBL4114242 0.79 USP30 (0.47) PRMT5WDR77GPR119USP30NAMPT
SCHEMBL19272766 0.77 TSHR (0.59) PRMT5WDR77GPR119USP30MAPK1
SCHEMBL30958416 0.77 GPR119 (0.43) PRMT5WDR77GPR119NAMPTMAPK1
SCHEMBL2676089 0.77 GPR119 (0.50) PRMT5WDR77GPR119NAMPTMAPK1
SCHEMBL4118999 0.76 GPR119 (0.49) PRMT5WDR77GPR119NAMPTKDM4E
SCHEMBL25387773 0.75 PRMT5 (0.54) PRMT5WDR77GPR119USP30NAMPT
SCHEMBL25385985 0.75 PRMT5 (0.54) PRMT5WDR77GPR119USP30NAMPT

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
EP-1487822-B1 PYRROLE-2,5-DIONE DERIVATIVES AND THEIR USE AS GSK-3 INHIBITORS LILLY CO ELI (US) 2007-08-01 EP disclosed