SCHEMBL25675535

SCHEMBL25675535

N#CN1CC[C@@H](NC(=O)c2ncc(-c3cccc(Cl)c3)o2)C1

nearest known ligand 0.57

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ USP30 Q70CQ3 17/20 0.57
▸ CTSL P07711 2/20 0.51
▸ CTSB P07858 2/20 0.51
▸ CTSK P43235 2/20 0.51
▸ HDAC1 Q13547 1/20 0.51
▸ HDAC6 Q9UBN7 1/20 0.51

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
SCHEMBL22585725 0.89 USP30 (0.57) USP30CTSLCTSBCTSK
SCHEMBL25675753 0.88 USP30 (0.56) USP30CTSLCTSBCTSK
SCHEMBL31017667 0.86 USP30 (0.54) USP30CTSLCTSBCTSKHDAC1
SCHEMBL25676690 0.86 USP30 (0.54) USP30CTSLCTSBCTSKHDAC1
SCHEMBL25676535 0.84 USP30 (0.52) USP30CTSLCTSBCTSK
SCHEMBL22585874 0.83 USP30 (0.53) USP30CTSBCTSK
SCHEMBL6485512 0.80 CHRNA7 (0.52) USP30HDAC1HDAC6
SCHEMBL6485506 0.80 CHRNA7 (0.52) USP30HDAC1HDAC6
SCHEMBL25676956 0.80 USP30 (0.49) USP30
SCHEMBL25675527 0.79 USP30 (0.58) USP30HDAC1HDAC6

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
WO-2023099561-A1 SUBSTITUTED N-CYANOPYRROLIDINES WITH ACTIVITY AS USP30 INHIBITORS MISSION THERAPEUTICS LIMITED (GB) 2023-06-08 — — WO disclosed
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