SCHEMBL29705273

SCHEMBL29705273

Cn1c(=O)n(C(=O)OC(C)(C)C)c2ncc(B3OC(C)(C)C(C)(C)O3)cc21

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
USP30 Q70CQ3 2/20 0.42
DGAT1 O75907 1/20 0.37
PRMT5 O14744 1/20 0.36
WDR77 Q9BQA1 1/20 0.36
AAK1 Q2M2I8 3/20 0.34
FFAR1 O14842 1/20 0.33
GABRG2 P18507 2/20 0.33
GABRB3 P28472 2/20 0.33
GABRA5 P31644 2/20 0.33
GABRA1 P14867 1/20 0.33
GABRA2 P47869 1/20 0.33
GABRA6 Q16445 1/20 0.33
GSK3A P49840 1/20 0.33
GSK3B P49841 1/20 0.33
HSD17B10 Q99714 2/20 0.33
HPGD P15428 1/20 0.33
HTT P42858 1/20 0.33
PDGFRB P09619 1/20 0.32
KDR P35968 1/20 0.32
PARG Q86W56 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
SCHEMBL27215181 1.00 USP30 (0.42) USP30DGAT1PRMT5WDR77AAK1
SCHEMBL2118034 0.91 USP30 (0.43) USP30DGAT1PRMT5WDR77AAK1
SCHEMBL13086540 0.84 USP30 (0.39) USP30DGAT1PRMT5WDR77AAK1
SCHEMBL3513272 0.80 HSD17B10 (0.50) DGAT1PRMT5WDR77AAK1FFAR1
SCHEMBL27215287 0.78 HSD17B10 (0.39) GABRG2GABRB3GABRA5GABRA1GABRA2
SCHEMBL29705389 0.78 HSD17B10 (0.39) GABRG2GABRB3GABRA5GABRA1GABRA2
SCHEMBL10223723 0.78 USP30 (0.33) USP30GABRG2GABRB3GABRA5
SCHEMBL27215192 0.77 HSD17B10 (0.58) USP30AAK1GABRG2GABRB3GABRA5
SCHEMBL29705392 0.77 HSD17B10 (0.58) USP30AAK1GABRG2GABRB3GABRA5
SCHEMBL12172282 0.75 PRMT5 (0.43) USP30DGAT1PRMT5WDR77AAK1

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-2022159745-A1 GCN2 MODULATING COMPOUNDS AND USES THEREOF HIBERCELL, INC. (US) 2022-07-28 WO disclosed