SCHEMBL28917529

SCHEMBL28917529

N#Cc1cccc(-c2cc(-c3cn([C@@H]4CCCN4C#N)cn3)ccn2)c1

nearest known ligand 0.55

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ USP30 Q70CQ3 18/20 0.55
▸ UCHL1 P09936 2/20 0.44
▸ GRM5 P41594 1/20 0.41
▸ LRRK2 Q5S007 1/20 0.40

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
SCHEMBL28590775 0.95 USP30 (0.59) USP30UCHL1GRM5
SCHEMBL28586441 0.90 USP30 (0.56) USP30UCHL1
SCHEMBL28592627 0.89 USP30 (0.48) USP30UCHL1
SCHEMBL28586845 0.89 USP30 (0.59) USP30UCHL1GRM5LRRK2
SCHEMBL28586425 0.86 USP30 (0.49) USP30UCHL1
SCHEMBL28594570 0.84 USP30 (0.56) USP30UCHL1
SCHEMBL28918193 0.84 USP30 (0.46) USP30UCHL1LRRK2
SCHEMBL28601185 0.83 USP30 (0.63) USP30UCHL1
SCHEMBL28918081 0.82 USP30 (0.46) USP30UCHL1LRRK2
SCHEMBL28603773 0.82 USP30 (0.50) USP30UCHL1

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
CN-108884068-B 1-cyano-pyrrolidine derivatives as DUB inhibitors 特殊治疗有限公司 2021-02-26 — — CN disclosed
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