SCHEMBL24317575

SCHEMBL24317575

COc1ccccc1CNCc1ccc2c3c(cccc13)N([C@H]1CCC(=O)NC1=O)C2=O

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
DDB1 Q16531 13/20 0.47
CRBN Q96SW2 13/20 0.47
TOP2A P11388 4/20 0.45
TDP1 Q9NUW8 2/20 0.43
ALDH1A1 P00352 1/20 0.43
CHRM2 P08172 1/20 0.43
OPRM1 P35372 1/20 0.43
IKZF3 Q9UKT9 1/20 0.43
CYP1A2 P05177 1/20 0.43
TSHR P16473 1/20 0.43
BCL2L11 O43521 1/20 0.43
BCL2 P10415 1/20 0.43
MCL1 Q07820 1/20 0.43
KDM4E B2RXH2 1/20 0.41

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
SCHEMBL27012683 1.00 DDB1 (0.47) DDB1CRBNTOP2ATDP1ALDH1A1
SCHEMBL24317477 0.91 CRBN (0.56) DDB1CRBNTDP1ALDH1A1CHRM2
SCHEMBL27012996 0.91 TOP2A (0.43) DDB1CRBNTOP2ATDP1BCL2L11
SCHEMBL27012686 0.86 CRBN (0.47) DDB1CRBNTDP1ALDH1A1CHRM2
SCHEMBL24317578 0.86 DDB1 (0.45) DDB1CRBNTDP1ALDH1A1CHRM2
SCHEMBL24317484 0.85 DDB1 (0.50) DDB1CRBNTDP1ALDH1A1CHRM2
SCHEMBL29532505 0.85 CRBN (0.52) DDB1CRBNTDP1ALDH1A1CHRM2
SCHEMBL24317452 0.85 CRBN (0.52) DDB1CRBNTDP1ALDH1A1CHRM2
SCHEMBL24317476 0.85 CRBN (0.49) DDB1CRBNTDP1ALDH1A1CHRM2
SCHEMBL24317479 0.84 CRBN (0.50) DDB1CRBNTDP1ALDH1A1CHRM2

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-2022081927-A1 TRICYCLIC COMPOUNDS TO DEGRADE NEOSUBSTRATES FOR MEDICAL THERAPY C4 THERAPEUTICS, INC. (US) 2022-04-21 WO disclosed