SCHEMBL25610969

SCHEMBL25610969

CC(C)Oc1cc(-c2cnc(NC(=O)[C@H]3CCCOC3)s2)ccc1C#N

nearest known ligand 0.45

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ USP30 Q70CQ3 4/20 0.45
▸ EGLN2 Q96KS0 2/20 0.45
▸ UCHL1 P09936 2/20 0.42
▸ S1PR1 P21453 2/20 0.41
▸ S1PR5 Q9H228 2/20 0.41
▸ ACACB O00763 1/20 0.40
▸ WNT1 P04628 2/20 0.40
▸ GSK3B P49841 2/20 0.40
▸ DYRK1A Q13627 2/20 0.40
▸ XDH P47989 1/20 0.39
▸ MKNK1 Q9BUB5 1/20 0.39
▸ CNR2 P34972 1/20 0.38
▸ FGFR4 P22455 1/20 0.38
▸ HDAC3 O15379 1/20 0.38
▸ HDAC1 Q13547 1/20 0.38
▸ HDAC2 Q92769 1/20 0.38
▸ TBK1 Q9UHD2 1/20 0.37

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
SCHEMBL25610970 1.00 USP30 (0.45) USP30EGLN2UCHL1S1PR1S1PR5
SCHEMBL25611309 0.87 USP30 (0.49) USP30EGLN2XDH
SCHEMBL25611109 0.85 USP30 (0.47) USP30EGLN2UCHL1S1PR1S1PR5
SCHEMBL25611033 0.84 USP30 (0.48) USP30EGLN2UCHL1S1PR1S1PR5
SCHEMBL25611227 0.84 UCHL1 (0.41) USP30UCHL1S1PR1S1PR5WNT1
SCHEMBL25605336 0.83 MKNK1 (0.59) USP30UCHL1S1PR1S1PR5WNT1
SCHEMBL25613444 0.82 XDH (0.43) USP30UCHL1S1PR1S1PR5XDH
SCHEMBL25611030 0.82 XDH (0.38) USP30UCHL1S1PR1S1PR5WNT1
SCHEMBL25610834 0.81 ABL1 (0.45) USP30UCHL1WNT1GSK3BDYRK1A
SCHEMBL31272082 0.80 S1PR1 (0.42) USP30EGLN2S1PR1S1PR5XDH

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-2023107714-A2 METHODS FOR TREATING NEUROLOGICAL DISORDERS PROTHENA BIOSCIENCES LIMITED (IE) 2023-06-15 — — WO disclosed
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