SCHEMBL28617990

SCHEMBL28617990

Cc1nc2cccc(NC(=O)CCCCC(N)=O)c2c(=O)n1C1CCC(=O)NC1=O

nearest known ligand 0.62

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CRBN Q96SW2 7/20 0.62
DDB1 Q16531 6/20 0.62
TNF P01375 1/20 0.62
IL1B P01584 1/20 0.62
IKZF3 Q9UKT9 1/20 0.62
HDAC3 O15379 6/20 0.42
HDAC1 Q13547 6/20 0.42
HDAC2 Q92769 6/20 0.42
NCOR2 Q9Y618 6/20 0.42
PIK3CA P42336 4/20 0.41
EGFR P00533 1/20 0.39
PDE6D O43924 3/20 0.37

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
SCHEMBL28612725 0.99 CRBN (0.61) CRBNDDB1TNFIL1BIKZF3
SCHEMBL26320556 0.96 CRBN (0.63) CRBNDDB1TNFIL1BIKZF3
SCHEMBL26324033 0.96 CRBN (0.62) CRBNDDB1TNFIL1BIKZF3
SCHEMBL26320535 0.96 CRBN (0.62) CRBNDDB1TNFIL1BIKZF3
SCHEMBL26320519 0.96 CRBN (0.62) CRBNDDB1TNFIL1BIKZF3
SCHEMBL26320573 0.96 CRBN (0.62) CRBNDDB1TNFIL1BIKZF3
SCHEMBL328600 0.93 CRBN (0.59) CRBNDDB1TNFIL1BIKZF3
SCHEMBL283111 0.92 CRBN (0.58) CRBNDDB1TNFIL1BIKZF3
SCHEMBL17049841 0.88 CRBN (0.59) CRBNDDB1TNFIL1BIKZF3
SCHEMBL30618973 0.88 DDB1 (0.67) CRBNDDB1TNFIL1BIKZF3

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-112512589-A Dimeric immunomodulatory compounds against CEREBLON-based mechanisms H·李·莫菲特癌症中心研究有限公司 2021-03-16 CN disclosed