SCHEMBL29348339

SCHEMBL29348339

CN1CCN(CCOc2ccc(-c3cccc([C@@H]4CCC(=O)NC4=O)c3Cl)cc2)CC1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CRBN Q96SW2 6/20 0.44
ESR1 P03372 1/20 0.44
DRD2 P14416 1/20 0.43
DDB1 Q16531 4/20 0.43
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
TNF P01375 2/20 0.42
IKZF3 Q9UKT9 1/20 0.42
PDCD1LG2 Q9BQ51 1/20 0.42
CD274 Q9NZQ7 1/20 0.42
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41
LTA4H P09960 1/20 0.41
PARP1 P09874 1/20 0.40
KDM4E B2RXH2 1/20 0.40
ALDH1A1 P00352 1/20 0.40
CXCR1 P25024 1/20 0.40
BMP4 P12644 1/20 0.40
FGFR1 P11362 1/20 0.40
SRC P12931 1/20 0.40

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
SCHEMBL29348368 0.92 TNF (0.49) CRBNESR1DRD2DDB1TNF
SCHEMBL29348353 0.86 TNF (0.41) CRBNESR1DRD2DDB1TNF
SCHEMBL29348358 0.84 CRBN (0.50) CRBNDRD2DDB1KMT2APDCD1LG2
SCHEMBL29348350 0.84 CRBN (0.49) CRBNDRD2DDB1KMT2APDCD1LG2
SCHEMBL29348367 0.83 CRBN (0.47) CRBNESR1DRD2DDB1KMT2A
SCHEMBL31068149 0.81 CRBN (0.46) CRBNDDB1PDCD1LG2CD274
SCHEMBL29348386 0.81 CRBN (0.46) CRBNDDB1PDCD1LG2CD274
SCHEMBL29348414 0.81 CRBN (0.46) CRBNDRD2DDB1TNFPDCD1LG2
SCHEMBL31068109 0.81 CRBN (0.46) CRBNDDB1PDCD1LG2CD274
SCHEMBL29348439 0.81 CRBN (0.46) CRBNDDB1PDCD1LG2CD274

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