SCHEMBL17632008

SCHEMBL17632008

CC1C(C(=O)Nc2ncc(C3CCOCC3)s2)CCN1C#N

nearest known ligand 0.44

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ UCHL1 P09936 3/20 0.44
▸ USP30 Q70CQ3 6/20 0.39
▸ CCNE1 P24864 7/20 0.37
▸ CDK2 P24941 7/20 0.37
▸ CDK5 Q00535 7/20 0.37
▸ CNR2 P34972 2/20 0.37
▸ CDK5R1 Q15078 1/20 0.36
▸ SMN1; SMN2 Q16637 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
SCHEMBL17644063 1.00 UCHL1 (0.44) UCHL1USP30CCNE1CDK2CDK5
SCHEMBL23452840 0.90 UCHL1 (0.40) UCHL1CCNE1CDK2CDK5CNR2
SCHEMBL20239934 0.84 USP30 (0.38) UCHL1USP30CCNE1CDK2CDK5
SCHEMBL17643828 0.77 UCHL1 (0.62) UCHL1USP30CNR2
SCHEMBL17631690 0.77 UCHL1 (0.62) UCHL1USP30CNR2
SCHEMBL17632106 0.77 UCHL1 (0.72) UCHL1USP30
SCHEMBL17632101 0.77 UCHL1 (0.72) UCHL1USP30
SCHEMBL17631844 0.76 USP30 (0.60) UCHL1USP30
SCHEMBL17643702 0.76 USP30 (0.60) UCHL1USP30
SCHEMBL23452856 0.76 USP30 (0.60) UCHL1USP30

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3197883-A1 NOVEL COMPOUNDS Mission Therapeutics Limited (GB) 2017-08-02 — — EP claimed
WO-2016046530-A1 NOVEL COMPOUNDS MISSION THERAPEUTICS LTD (GB) 2016-03-31 — — WO claimed
EP-3197883-A1 NOVEL COMPOUNDS Mission Therapeutics Limited (GB) 2017-08-02 — — EP disclosed
WO-2016046530-A1 NOVEL COMPOUNDS MISSION THERAPEUTICS LTD (GB) 2016-03-31 — — WO disclosed
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