SCHEMBL30472913

SCHEMBL30472913

CNc1cccc2c(N3CCC(=O)NC3=O)nn(C)c12

nearest known ligand 0.72

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CRBN Q96SW2 18/20 0.72
DDB1 Q16531 17/20 0.72
MEN1 O00255 1/20 0.36
USP2 O75604 1/20 0.36
KMT2A Q03164 1/20 0.36
KEAP1 Q14145 1/20 0.36
NFE2L2 Q16236 1/20 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
SCHEMBL30199279 0.86 CRBN (0.67) CRBNDDB1MEN1KMT2A
Hydrochloric Acid SCHEMBL30199319 0.85 CRBN (0.65) CRBNDDB1MEN1KMT2A
SCHEMBL25026932 0.84 CRBN (0.77) CRBNDDB1
SCHEMBL30472890 0.84 CRBN (1.00) CRBNDDB1MEN1USP2KMT2A
SCHEMBL28984072 0.84 CRBN (1.00) CRBNDDB1MEN1USP2KMT2A
SCHEMBL30472911 0.84 DDB1 (0.63) CRBNDDB1
SCHEMBL31254098 0.84 CRBN (0.63) CRBNDDB1
SCHEMBL25595586 0.83 CRBN (0.76) CRBNDDB1
SCHEMBL25578237 0.83 CRBN (0.80) CRBNDDB1
SCHEMBL25858510 0.82 CRBN (0.52) 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
CN-115968293-A Cereblon binding compounds, compositions thereof, and methods of use thereof for treatment 新基公司 2023-04-14 CN disclosed