SCHEMBL29268982

SCHEMBL29268982

CC(C)(C)OC(=O)N1CC(NC(=O)c2ncc(-c3cccc(Cl)c3)o2)CC1Cn1ccnn1

nearest known ligand 0.42

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ HDAC1 Q13547 6/20 0.42
▸ HDAC6 Q9UBN7 6/20 0.42
▸ USP30 Q70CQ3 7/20 0.39
▸ UCHL1 P09936 1/20 0.34
▸ POLB P06746 1/20 0.34
▸ NPC1 O15118 2/20 0.33
▸ RAB9A P51151 2/20 0.33
▸ RORC P51449 1/20 0.33
▸ GABRA5 P31644 1/20 0.32
▸ GRM5 P41594 1/20 0.32

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
SCHEMBL30474034 1.00 HDAC1 (0.42) HDAC1HDAC6USP30UCHL1POLB
SCHEMBL29268985 1.00 HDAC1 (0.42) HDAC1HDAC6USP30UCHL1POLB
SCHEMBL29268997 0.92 HDAC1 (0.42) HDAC1HDAC6USP30RORCGABRA5
SCHEMBL29268998 0.92 HDAC1 (0.42) HDAC1HDAC6USP30RORCGABRA5
SCHEMBL30474006 0.92 HDAC1 (0.42) HDAC1HDAC6USP30RORCGABRA5
SCHEMBL25675708 0.92 HDAC1 (0.42) HDAC1HDAC6USP30RORCGABRA5
SCHEMBL25675712 0.91 FAAH (0.34) HDAC1HDAC6USP30RORC
SCHEMBL30474019 0.91 FAAH (0.34) HDAC1HDAC6USP30RORC
SCHEMBL24073258 0.90 HDAC1 (0.44) HDAC1HDAC6USP30RORC
SCHEMBL29269034 0.90 HDAC1 (0.34) HDAC1HDAC6USP30RORCGABRA5

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-118302422-A Substituted N-cyanopyrrolidines having activity as USP30 inhibitors 特殊治疗有限公司 2024-07-05 — — CN disclosed
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