SCHEMBL30683092

SCHEMBL30683092

COCc1cc(C#C[Si](C)(C)C)ccc1CNC(=O)OC(C)(C)C

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 4/20 0.40
GABRA5 P31644 4/20 0.40
GABRG2 P18507 3/20 0.40
GABRB3 P28472 3/20 0.40
GABRA3 P34903 3/20 0.40
GABRA2 P47869 3/20 0.40
GABRA6 Q16445 3/20 0.40
PTPN11 Q06124 1/20 0.38
KDM4A O75164 1/20 0.37
L3MBTL1 Q9Y468 2/20 0.36
GFER P55789 1/20 0.36
HSD17B10 Q99714 1/20 0.36
GABRA4 P48169 2/20 0.35
GABRB2 P47870 1/20 0.35
ADRA2A P08913 1/20 0.35
DRD5 P21918 1/20 0.35
DRD3 P35462 1/20 0.35
P2RY6 Q15077 1/20 0.35
KDM4E B2RXH2 1/20 0.35
LMNA P02545 1/20 0.35

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
SCHEMBL24837814 0.86 TRPV1 (0.42) GABRA1GABRA5GABRG2GABRB3GABRA3
SCHEMBL30178965 0.85 GABRA1 (0.42) GABRA1GABRA5GABRG2GABRB3GABRA3
SCHEMBL24837858 0.85 GABRA1 (0.42) GABRA1GABRA5GABRG2GABRB3GABRA3
SCHEMBL24838771 0.85 GABRA1 (0.42) GABRA1GABRA5GABRG2GABRB3GABRA3
SCHEMBL24838313 0.84 IDO1 (0.43) GABRA1GABRA5GABRG2GABRB3GABRA3
SCHEMBL15729791 0.84 GABRA1 (0.41) GABRA1GABRA5GABRG2GABRB3GABRA3
SCHEMBL26931830 0.84 GABRA1 (0.41) GABRA1GABRA5GABRG2GABRB3GABRA3
SCHEMBL1476738 0.84 GABRA1 (0.41) GABRA1GABRA5GABRG2GABRB3GABRA3
SCHEMBL26931908 0.84 KDM4A (0.39) GABRA1GABRA5GABRG2GABRB3GABRA3
SCHEMBL26932026 0.81 GABRA5 (0.39) GABRA1GABRA5GABRG2GABRB3GABRA3

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