SCHEMBL23634848

SCHEMBL23634848

CN(CCOc1ccc2c(ccc3occ([C@H]4CCC(=O)NC4=O)c32)c1)C1CCN(S(C)(=O)=O)CC1

nearest known ligand 0.34

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CRBN Q96SW2 6/20 0.34
PDE3B Q13370 3/20 0.33
PDE3A Q14432 3/20 0.33
SRC P12931 2/20 0.33
NUAK1 O60285 1/20 0.32
ALK Q9UM73 2/20 0.31
HRH3 Q9Y5N1 2/20 0.31
DDB1 Q16531 5/20 0.31
DRD2 P14416 1/20 0.30
DRD3 P35462 1/20 0.30

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
SCHEMBL23635061 1.00 CRBN (0.34) CRBNPDE3BPDE3ASRCNUAK1
SCHEMBL23634834 1.00 CRBN (0.34) CRBNPDE3BPDE3ASRCNUAK1
SCHEMBL23635055 0.91 CRBN (0.36) CRBNPDE3BPDE3ANUAK1HRH3
SCHEMBL23635004 0.91 CRBN (0.36) CRBNPDE3BPDE3ANUAK1HRH3
SCHEMBL23635002 0.91 CRBN (0.36) CRBNPDE3BPDE3ANUAK1HRH3
SCHEMBL25864756 0.89 CRBN (0.36) CRBNPDE3BPDE3ANUAK1HRH3
SCHEMBL23634902 0.89 PDE3B (0.41) CRBNPDE3BPDE3A
SCHEMBL23634864 0.89 PDE3B (0.41) CRBNPDE3BPDE3A
SCHEMBL23634843 0.89 PDE3B (0.41) CRBNPDE3BPDE3A
SCHEMBL23634839 0.88 CRBN (0.37) CRBNPDE3BPDE3ANUAK1DDB1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3848363-B1 TRICYCLIC SUBSTITUTED PIPERIDINE DIONE COMPOUND MEDSHINE DISCOVERY INC (CN) 2023-07-19 EP disclosed
EP-3848363-A1 TRICYCLIC SUBSTITUTED PIPERIDINE DIONE COMPOUND Medshine Discovery Inc. (CN) 2021-07-14 EP disclosed