SCHEMBL29348691

SCHEMBL29348691

O=C1CCC(c2cccc(-c3cnc4c(c3)CCCN4)c2Cl)C(=O)N1

nearest known ligand 0.41

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
FEN1 P39748 5/20 0.41
ALOX5AP P20292 4/20 0.41
CRBN Q96SW2 12/20 0.39
DDB1 Q16531 11/20 0.39
NNMT P40261 1/20 0.35
PIK3CD O00329 1/20 0.34
PDCD1LG2 Q9BQ51 1/20 0.34
CD274 Q9NZQ7 1/20 0.34

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
SCHEMBL31068152 0.87 ALOX5AP (0.46) FEN1ALOX5AP
SCHEMBL31068108 0.84 DDB1 (0.42) CRBNDDB1
SCHEMBL29348683 0.84 DDB1 (0.42) CRBNDDB1
SCHEMBL31068353 0.78 DDB1 (0.43) CRBNDDB1
SCHEMBL31068317 0.77 ALOX5AP (0.43) FEN1ALOX5APCRBNDDB1
SCHEMBL29348595 0.77 ALOX5AP (0.43) FEN1ALOX5APCRBNDDB1
SCHEMBL31068241 0.75 DDB1 (0.56) CRBNDDB1
SCHEMBL31068193 0.74 BRD4 (0.43) CRBNDDB1
SCHEMBL29348596 0.74 BRD4 (0.43) CRBNDDB1
SCHEMBL31068156 0.74 DDB1 (0.44) CRBNDDB1

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-2024151547-A1 TARGETED DEGRADATION OF VAV1 MONTE ROSA THERAPEUTICS, INC. (US) 2024-07-18 WO disclosed