SCHEMBL30683043

SCHEMBL30683043

COCCOc1cc(C#C[Si](C)(C)C)cnc1CNC(=O)OC(C)(C)C

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 2/20 0.37
GABRA1 P14867 1/20 0.36
GABRG2 P18507 1/20 0.36
GABRB3 P28472 1/20 0.36
GABRA5 P31644 1/20 0.36
GABRA3 P34903 1/20 0.36
GABRA2 P47869 1/20 0.36
GABRA6 Q16445 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.34
PTPN11 Q06124 1/20 0.34
SYK P43405 1/20 0.33
PRMT5 O14744 1/20 0.33
WDR77 Q9BQA1 1/20 0.33
NAMPT P43490 1/20 0.33
EGLN1 Q9GZT9 2/20 0.33
DYRK1A Q13627 1/20 0.33
KDM4A O75164 1/20 0.32
MAPKAPK2 P49137 1/20 0.32
ACACB O00763 1/20 0.32
CA12 O43570 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
SCHEMBL24838773 0.89 GABRA1 (0.40) GABRA1GABRG2GABRB3GABRA5GABRA3
SCHEMBL26932126 0.89 GABRA1 (0.36) GABRA1GABRG2GABRB3GABRA5GABRA3
SCHEMBL30683098 0.89 GABRA1 (0.36) GABRA1GABRG2GABRB3GABRA5GABRA3
SCHEMBL30683085 0.86 BRD4 (0.38) BRD4L3MBTL1SYKPRMT5WDR77
SCHEMBL26932131 0.86 EGLN1 (0.35) GABRA1GABRG2GABRB3GABRA5GABRA3
SCHEMBL30683031 0.81 AAK1 (0.41) BRD4L3MBTL1SYKNAMPTKDM4A
SCHEMBL26932089 0.78 GABRA1 (0.32) GABRA1GABRG2GABRB3GABRA5GABRA3
SCHEMBL30683019 0.77 PRMT5 (0.34) GABRA1GABRG2GABRB3GABRA5GABRA3
SCHEMBL26932140 0.77 PRMT5 (0.34) GABRA1GABRG2GABRB3GABRA5GABRA3
SCHEMBL24838775 0.75 EGLN1 (0.38) GABRA1GABRG2GABRB3GABRA5GABRA3

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-2023239645-A1 SMARCA DEGRADERS AND USES THEREOF KYMERA THERAPEUTICS, INC. (US) 2023-12-14 WO disclosed