SCHEMBL23019804

SCHEMBL23019804

CC(C)(C)OC(=O)N1CCC(NC(=O)c2ccc(Nc3ncccn3)cc2F)C1

nearest known ligand 0.63

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
USP30 Q70CQ3 12/20 0.63
RIPK1 Q13546 1/20 0.49
PARP1 P09874 1/20 0.47
IGF1R P08069 2/20 0.47
CDK1 P06493 1/20 0.46
CDK2 P24941 1/20 0.46
HDAC4 P56524 1/20 0.46
HDAC6 Q9UBN7 1/20 0.46
ADORA3 P0DMS8 1/20 0.46
ADORA2A P29274 1/20 0.46
ADORA2B P29275 1/20 0.46
JAK2 O60674 1/20 0.45
BRD4 O60885 1/20 0.45
JAK1 P23458 1/20 0.45
BRD2 P25440 1/20 0.45
JAK3 P52333 1/20 0.45
BRD3 Q15059 1/20 0.45
BRDT Q58F21 1/20 0.45

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
SCHEMBL18124191 1.00 USP30 (0.63) USP30RIPK1PARP1IGF1RCDK1
SCHEMBL18116016 0.86 CDK2 (0.49) USP30CDK1CDK2JAK2BRD4
SCHEMBL19990920 0.86 CDK2 (0.49) USP30CDK1CDK2JAK2BRD4
SCHEMBL28513485 0.82 USP30 (0.67) USP30RIPK1PARP1HDAC4HDAC6
SCHEMBL29778997 0.82 USP30 (0.67) USP30RIPK1PARP1HDAC4HDAC6
SCHEMBL18124183 0.82 USP30 (0.67) USP30RIPK1PARP1HDAC4HDAC6
SCHEMBL18124204 0.81 USP30 (0.70) USP30RIPK1PARP1HDAC4HDAC6
SCHEMBL23019685 0.81 USP30 (0.70) USP30RIPK1PARP1HDAC4HDAC6
SCHEMBL29779090 0.81 USP30 (0.70) USP30RIPK1PARP1HDAC4HDAC6
SCHEMBL18115533 0.79 USP30 (0.62) USP30

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-3277677-B1 1-CYANO-PYRROLIDINE COMPOUNDS AS USP30 INHIBITORS MISSION THERAPEUTICS LTD (GB) 2021-02-24 EP disclosed