SCHEMBL23842020

SCHEMBL23842020

Cn1c(=O)n(C2CCC(=O)NC2=O)c2cccc(CCC3CC4(CCN(CC5CCCCC5)CC4)C3)c21

nearest known ligand 0.46

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
DDB1 Q16531 8/20 0.46
CRBN Q96SW2 8/20 0.46
OPRM1 P35372 8/20 0.36
OPRL1 P41146 8/20 0.36
OPRK1 P41145 7/20 0.36
DRD2 P14416 3/20 0.35
DRD4 P21917 1/20 0.35
DRD3 P35462 1/20 0.35
SIGMAR1 Q99720 2/20 0.34
IKZF1 Q13422 1/20 0.34
IKZF2 Q9UKS7 1/20 0.34
OPRD1 P41143 1/20 0.33

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
SCHEMBL27171536 0.92 CRBN (0.45) DDB1CRBNIKZF1IKZF2
SCHEMBL23842385 0.90 DDB1 (0.47) DDB1CRBNOPRM1OPRL1OPRK1
SCHEMBL21996833 0.86 DDB1 (0.52) DDB1CRBN
SCHEMBL31003851 0.85 DDB1 (0.54) DDB1CRBN
SCHEMBL23832600 0.85 DRD2 (0.41) DDB1CRBNDRD2DRD3
SCHEMBL27171545 0.82 DDB1 (0.46) DDB1CRBNIKZF1IKZF2
SCHEMBL21997902 0.82 DDB1 (0.44) DDB1CRBN
SCHEMBL26448008 0.80 DDB1 (0.57) DDB1CRBN
SCHEMBL25934140 0.80 CRBN (0.47) DDB1CRBNIKZF1IKZF2
SCHEMBL21997035 0.79 DDB1 (0.56) DDB1CRBN

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-2021188948-A1 MDM2 DEGRADERS AND USES THEREOF KYMERA THERAPEUTICS, INC. (US) 2021-09-23 WO disclosed