SCHEMBL31569732

SCHEMBL31569732

CC(C)(C)OC(=O)N1CCN(Cc2nc3cc(Br)ccc3[nH]2)CC1

nearest known ligand 0.44

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TBK1 Q9UHD2 14/20 0.44
BACE1 P56817 1/20 0.43
DRD2 P14416 1/20 0.43
DRD4 P21917 1/20 0.43
IKBKE Q14164 1/20 0.42
KCNH2 Q12809 1/20 0.41
LMNA P02545 1/20 0.41
MAPT P10636 1/20 0.41
PDE3B Q13370 1/20 0.41
PDE3A Q14432 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
SCHEMBL28634875 0.85 MAPT (0.52) DRD4LMNAMAPT
SCHEMBL31569825 0.82 KCNH2 (0.57) BACE1KCNH2LMNAMAPTPDE3B
SCHEMBL23964227 0.81 LMNA (0.53) TBK1BACE1DRD4LMNA
SCHEMBL23932558 0.80 RPS6KB1 (0.55) TBK1KCNH2
SCHEMBL31569805 0.78 DDB1 (0.56) TBK1PDE3BPDE3A
SCHEMBL12026566 0.78 MAPT (0.47) LMNAMAPT
SCHEMBL31569998 0.77 KMT2A (0.56) LMNA
SCHEMBL31569643 0.77 PIK3CA (0.44) TBK1BACE1IKBKE
SCHEMBL2325142 0.77 HTT (0.62) DRD2DRD4MAPT
SCHEMBL8126555 0.76 VEGFA (0.46) TBK1BACE1

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-2025101588-A1 TETRAHYDROISOQUINOLINE HETEROBIFUNCTIONAL BCL-XL DEGRADERS Treeline Biosciences, Inc. (US) 2025-05-15 WO disclosed