SCHEMBL22904553

SCHEMBL22904553

NCCCC#Cc1ccc(Oc2cccc3c2C(=O)NC(=O)C3)cc1

nearest known ligand 0.39

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ TDP2 O95551 4/20 0.39
▸ CASP3 P42574 1/20 0.32
▸ CASP7 P55210 1/20 0.32
▸ CASP9 P55211 1/20 0.32
▸ CASP6 P55212 1/20 0.32
▸ CASP8 Q14790 1/20 0.32
▸ MAP3K14 Q99558 1/20 0.32
▸ PPARG P37231 1/20 0.31
▸ PPARD Q03181 1/20 0.31
▸ PPARA Q07869 1/20 0.31
▸ AHR P35869 1/20 0.30
▸ GRIN1 Q05586 1/20 0.30

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
SCHEMBL22904452 0.90 TDP2 (0.38) TDP2CASP3CASP7CASP9CASP6
SCHEMBL22904454 0.86 TDP2 (0.36) TDP2GRIN1
SCHEMBL22904457 0.86 TDP2 (0.36) TDP2GRIN1
SCHEMBL22904250 0.81 STK10 (0.33) CASP3CASP7CASP6CASP8PPARG
SCHEMBL22904153 0.80 TDP2 (0.41) TDP2CASP3CASP7CASP9CASP6
SCHEMBL22904458 0.80 TDP2 (0.41) TDP2CASP3CASP7CASP9CASP6
SCHEMBL22904154 0.80 TDP2 (0.41) TDP2CASP3CASP7CASP9CASP6
SCHEMBL22904496 0.79 TDP2 (0.40) TDP2CASP3CASP7CASP9CASP6
SCHEMBL22904525 0.75 TDP2 (0.54) TDP2CASP3CASP7CASP9CASP6
SCHEMBL22904298 0.75 TDP2 (0.50) 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
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