SCHEMBL22904264

SCHEMBL22904264

Cc1ccccc1-c1ccc2c(c1)C(=O)NC(=O)C2

nearest known ligand 0.68

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
GRIA1 P42261 1/20 0.68
CACNG8 Q8WXS5 1/20 0.68
TDP2 O95551 19/20 0.60
CASP3 P42574 1/20 0.58
CASP7 P55210 1/20 0.58
CASP9 P55211 1/20 0.58
CASP6 P55212 1/20 0.58
CASP8 Q14790 1/20 0.58
MAP3K14 Q99558 1/20 0.58

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
SCHEMBL5782680 0.84 GRIA1 (0.78) GRIA1CACNG8TDP2CASP3CASP7
SCHEMBL22904161 0.82 TDP2 (0.60) TDP2CASP3CASP7CASP9CASP6
SCHEMBL22904230 0.82 TDP2 (0.62) GRIA1CACNG8TDP2CASP3CASP7
SCHEMBL10714302 0.81 GRIA1 (1.00) GRIA1CACNG8TDP2
SCHEMBL4895870 0.79 GRIA1 (0.53) GRIA1CACNG8
SCHEMBL22904088 0.78 GSK3B (0.54) GRIA1CACNG8CASP3CASP7CASP6
SCHEMBL13177568 0.76 TDP2 (0.64) TDP2CASP3CASP7CASP9CASP6
SCHEMBL18010794 0.75 TDP2 (1.00) TDP2
SCHEMBL18010839 0.75 TDP2 (1.00) TDP2
SCHEMBL422023 0.75 TDP2 (1.00) TDP2CASP3CASP7CASP9CASP6

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-2021011631-A1 FUSED-GLUTARIMIDE CRBN LIGANDS AND USES THEREOF KYMERA THERAPEUTICS, INC. (US) 2021-01-21 WO disclosed