SCHEMBL29158597

SCHEMBL29158597

COCC1CC(NC(=O)c2nnc(-c3cccc(C#N)c3)o2)CN1C(=O)O

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ USP30 Q70CQ3 1/20 0.42
▸ TNKS O95271 1/20 0.37
▸ PARP2 Q9UGN5 1/20 0.37
▸ LRRK2 Q5S007 3/20 0.37
▸ CPT2 P23786 1/20 0.36
▸ CPT1A P50416 1/20 0.36
▸ FAAH O00519 1/20 0.36
▸ CHRM3 P20309 1/20 0.35
▸ F11 P03951 1/20 0.35
▸ MMP2 P08253 1/20 0.35
▸ ALOX12 P18054 1/20 0.35
▸ GRM5 P41594 2/20 0.35
▸ EGLN1 Q9GZT9 1/20 0.35
▸ MAPK14 Q16539 1/20 0.35
▸ TP53 P04637 1/20 0.34
▸ MAPT P10636 1/20 0.34

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
SCHEMBL23069407 1.00 USP30 (0.42) USP30TNKSPARP2LRRK2CPT2
SCHEMBL23069429 0.90 USP30 (0.42) USP30TNKSPARP2LRRK2CPT2
SCHEMBL29158602 0.90 USP30 (0.42) USP30TNKSPARP2LRRK2CPT2
SCHEMBL29158595 0.89 USP30 (0.39) USP30TNKSPARP2LRRK2CPT2
SCHEMBL29158591 0.89 USP30 (0.39) USP30TNKSPARP2LRRK2CPT2
SCHEMBL23085670 0.89 USP30 (0.39) USP30TNKSPARP2LRRK2CPT2
SCHEMBL29770996 0.89 USP30 (0.39) USP30TNKSPARP2LRRK2CPT2
SCHEMBL23069424 0.89 USP30 (0.44) USP30TNKSPARP2LRRK2CHRM3
SCHEMBL29470214 0.89 USP30 (0.44) USP30TNKSPARP2LRRK2CHRM3
SCHEMBL23069418 0.88 USP30 (0.42) USP30TNKSPARP2LRRK2FAAH

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-114341133-B Substituted cyanopyrrolidines having USP30 inhibitor activity 特殊治疗有限公司 2024-02-27 — — CN disclosed
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