SCHEMBL27305643

SCHEMBL27305643

N#CN1CC[C@H](NC(=O)Cc2ccccc2)C1

nearest known ligand 0.86

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ USP30 Q70CQ3 14/20 0.86
▸ CTSL P07711 4/20 0.70
▸ CTSB P07858 4/20 0.70
▸ CTSK P43235 3/20 0.70
▸ CTSS P25774 1/20 0.64
▸ CTSC P53634 1/20 0.64
▸ SIGMAR1 Q99720 2/20 0.59

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
SCHEMBL14513401 1.00 USP30 (0.86) USP30CTSLCTSBCTSKCTSS
SCHEMBL18115519 0.92 USP30 (1.00) USP30CTSLCTSBCTSKCTSS
SCHEMBL6851774 0.82 CTSL (1.00) USP30CTSLCTSBCTSKCTSS
SCHEMBL6851697 0.81 CTSB (1.00) USP30CTSLCTSBCTSKCTSS
SCHEMBL6858432 0.77 CTSL (0.66) USP30CTSLCTSBCTSKCTSS
Cyanamide SCHEMBL6859700 0.77 CTSB (0.92) USP30CTSLCTSBCTSKCTSS
SCHEMBL21324958 0.77 CTSB (0.93) USP30CTSLCTSBCTSKCTSS
SCHEMBL18115550 0.77 USP30 (1.00) USP30CTSLCTSBCTSKCTSS
SCHEMBL6858886 0.76 CTSB (1.00) USP30CTSLCTSBCTSKCTSS
SCHEMBL7009469 0.76 CTSB (1.00) USP30CTSLCTSBCTSKCTSS

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
WO-2024006956-A9 DEUBIQUITINASE INHIBITORS AND METHODS OF USE THEREOF DANA-FARBER CANCER INSTITUTE, INC. (US) 2024-04-11 — — WO disclosed
WO-2024006956-A2 DEUBIQUITINASE INHIBITORS AND METHODS OF USE THEREOF DANA-FARBER CANCER INSTITUTE, INC. (US) 2024-01-04 — — WO disclosed
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