SCHEMBL8303883

SCHEMBL8303883

COc1cccc(C2CC(=O)NC2=O)c1

nearest known ligand 0.74

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
DDB1 Q16531 2/20 0.74
CRBN Q96SW2 2/20 0.74
NPC1 O15118 2/20 0.62
MEN1 O00255 1/20 0.62
KMT2A Q03164 1/20 0.62
ALDH1A1 P00352 2/20 0.60
MAPK1 P28482 1/20 0.57
IDO1 P14902 1/20 0.53
USP2 O75604 1/20 0.53
MAPT P10636 2/20 0.50
GAA P10253 1/20 0.50
THRB P10828 1/20 0.50
TDP1 Q9NUW8 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
PKM P14618 2/20 0.49
LMNA P02545 1/20 0.49

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
SCHEMBL26053605 0.85 CRBN (1.00) DDB1CRBNNPC1MEN1KMT2A
SCHEMBL880441 0.82 MEN1 (0.69) DDB1CRBNNPC1MEN1KMT2A
SCHEMBL2003982 0.82 DDB1 (0.59) DDB1CRBNNPC1MEN1KMT2A
SCHEMBL27965543 0.81 CRBN (0.71) DDB1CRBNNPC1IDO1MAPT
SCHEMBL880352 0.80 KMT2A (0.73) DDB1CRBNNPC1MEN1KMT2A
SCHEMBL5354030 0.80 TDP1 (0.59) DDB1CRBNNPC1MEN1KMT2A
SCHEMBL19167206 0.78 DDB1 (0.54) DDB1CRBNNPC1MEN1KMT2A
SCHEMBL18618445 0.77 DDB1 (0.53) DDB1CRBNNPC1MEN1KMT2A
SCHEMBL880432 0.77 TP53 (0.69) DDB1CRBNNPC1MEN1KMT2A
SCHEMBL14942712 0.77 SMN1; SMN2 (0.64) DDB1CRBNNPC1MEN1KMT2A

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-0898569-A1 PIPERIDINES AND PYRROLIDINES MERCK PATENT GmbH (DE) 1999-03-03 EP disclosed
WO-1997040038-A1 PIPERIDINES AND PYRROLIDINES MERCK PATENT GMBH (DE) 1997-10-30 WO disclosed