SCHEMBL29364252

SCHEMBL29364252

CC(C)(C)OC(=O)N1CCC(Oc2ccc(Br)cc2Cl)C1

nearest known ligand 0.51

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 3/20 0.51
PIK3CD O00329 4/20 0.48
PIK3CA P42336 2/20 0.48
PIK3CB P42338 2/20 0.48
PIK3CG P48736 2/20 0.48
USP30 Q70CQ3 3/20 0.47
PDE4D Q08499 3/20 0.47
PDE4A P27815 2/20 0.47
PDE4C Q08493 2/20 0.47
GPR119 Q8TDV5 1/20 0.46
TOP2A P11388 1/20 0.46
NPBWR1 P48145 1/20 0.43
MCHR1 Q99705 1/20 0.43
ALDH1A1 P00352 1/20 0.43
RECQL P46063 1/20 0.42
STS P08842 1/20 0.42
KDM1A O60341 1/20 0.42

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
SCHEMBL26180101 1.00 PDE4B (0.51) PDE4BPIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL18318290 0.93 PDE4B (0.53) PDE4BPDE4DPDE4APDE4CGPR119
SCHEMBL22953433 0.88 PDE4B (0.52) PDE4BPIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL29363719 0.87 GPR119 (0.58) PDE4BPIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL20439351 0.87 GPR119 (0.58) PDE4BPIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL20439353 0.87 GPR119 (0.58) PDE4BPIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL279184 0.85 PDE4B (0.49) PDE4BPIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL3400187 0.85 PDE4B (0.49) PDE4BPIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL38662418 0.85 PDE4B (0.49) PDE4BUSP30
SCHEMBL3400190 0.85 PDE4B (0.49) PDE4BPIK3CDPIK3CAPIK3CBPIK3CG

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-4182320-A1 INDOLE COMPOUNDS AS ANDROGEN RECEPTOR MODULATORS Nido Biosciences, Inc. (US) 2023-05-24 EP disclosed
WO-2022020342-A1 INDOLE COMPOUNDS AS ANDROGEN RECEPTOR MODULATORS NIDO BIOSCIENCES, INC. (US) 2022-01-27 WO disclosed