SCHEMBL18900533

SCHEMBL18900533

Cc1cccc(C(=O)NCC2CC=Cc3nc(C)n(C4CCC(=O)NC4=O)c(=O)c32)c1

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CRBN Q96SW2 12/20 0.43
CSNK1A1 P48729 2/20 0.43
DDB1 Q16531 9/20 0.42
TNF P01375 1/20 0.42
IL1B P01584 1/20 0.42
IKZF3 Q9UKT9 1/20 0.42
HPGD P15428 1/20 0.37
OPRM1 P35372 1/20 0.37
OPRK1 P41145 1/20 0.37
DRD2 P14416 2/20 0.36
DRD4 P21917 2/20 0.35
ALDH1A1 P00352 1/20 0.35
POLB P06746 1/20 0.35
UBE2M P61081 1/20 0.34
DCUN1D1 Q96GG9 1/20 0.34
IKZF1 Q13422 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
SCHEMBL19526076 0.81 CRBN (0.42) CRBNDDB1TNFIL1BIKZF3
SCHEMBL24113869 0.76 CRBN (0.58) CRBNCSNK1A1DDB1TNFIL1B
SCHEMBL283824 0.76 CRBN (0.58) CRBNCSNK1A1DDB1TNFIL1B
SCHEMBL328540 0.73 DDB1 (0.56) CRBNDDB1TNFIL1BIKZF3
SCHEMBL18904211 0.73 CRBN (0.52) CRBNDDB1TNFIL1BIKZF3
SCHEMBL282617 0.68 CRBN (0.56) CRBNCSNK1A1DDB1TNFIL1B
SCHEMBL12638455 0.68 CRBN (0.47) CRBNCSNK1A1DDB1TNFIL1B
SCHEMBL283159 0.68 CRBN (0.60) CRBNCSNK1A1DDB1TNFIL1B
SCHEMBL282665 0.67 CRBN (0.59) CRBNCSNK1A1DDB1TNFIL1B
SCHEMBL287793 0.67 CRBN (0.54) CRBNCSNK1A1DDB1TNFIL1B

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
EP-2428513-B1 5-substituted quinazolinone derivatives as anti-cancer agents CELGENE CORP (US) 2017-05-31 EP disclosed