SCHEMBL24837814

SCHEMBL24837814

COc1cc(C#C[Si](C)(C)C)ccc1CNC(=O)OC(C)(C)C

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 1/20 0.42
GABRA1 P14867 4/20 0.41
GABRA5 P31644 4/20 0.41
GABRG2 P18507 3/20 0.41
GABRB3 P28472 3/20 0.41
GABRA3 P34903 3/20 0.41
GABRA2 P47869 3/20 0.41
GABRA6 Q16445 3/20 0.41
ABCB1 P08183 1/20 0.41
PTPN11 Q06124 1/20 0.40
KDM4A O75164 1/20 0.38
L3MBTL1 Q9Y468 2/20 0.37
GFER P55789 1/20 0.37
HSD17B10 Q99714 1/20 0.37
DYRK1A Q13627 1/20 0.37
ALDH1A1 P00352 1/20 0.37
TSHR P16473 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
DRD2 P14416 1/20 0.36
GABRA4 P48169 2/20 0.36

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
SCHEMBL26932101 0.88 GABRA1 (0.38) TRPV1GABRA1GABRA5GABRG2GABRB3
SCHEMBL24838771 0.87 GABRA1 (0.42) TRPV1GABRA1GABRA5GABRG2GABRB3
SCHEMBL30178965 0.87 GABRA1 (0.42) GABRA1GABRA5GABRG2GABRB3GABRA3
SCHEMBL24837858 0.87 GABRA1 (0.42) GABRA1GABRA5GABRG2GABRB3GABRA3
SCHEMBL24838783 0.87 TRPV1 (0.44) TRPV1ABCB1PTPN11KDM4AL3MBTL1
SCHEMBL30683092 0.86 GABRA1 (0.40) TRPV1GABRA1GABRA5GABRG2GABRB3
SCHEMBL15729791 0.86 GABRA1 (0.41) TRPV1GABRA1GABRA5GABRG2GABRB3
SCHEMBL26931830 0.86 GABRA1 (0.41) GABRA1GABRA5GABRG2GABRB3GABRA3
SCHEMBL24838313 0.86 IDO1 (0.43) TRPV1GABRA1GABRA5GABRG2GABRB3
SCHEMBL23775495 0.84 ABCB1 (0.43) TRPV1ABCB1PTPN11KDM4AALDH1A1

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
WO-2023239645-A1 SMARCA DEGRADERS AND USES THEREOF KYMERA THERAPEUTICS, INC. (US) 2023-12-14 WO disclosed
WO-2023239645-A1 SMARCA DEGRADERS AND USES THEREOF KYMERA THERAPEUTICS, INC. (US) 2023-12-14 WO disclosed
WO-2023278402-A1 SMARCA DEGRADERS AND USES THEREOF KYMERA THERAPEUTICS, INC. (US) 2023-01-05 WO disclosed
WO-2023278402-A1 SMARCA DEGRADERS AND USES THEREOF KYMERA THERAPEUTICS, INC. (US) 2023-01-05 WO disclosed