SCHEMBL23605477

SCHEMBL23605477

CC(C)(C)OC(=O)N1CCCC(Oc2cncnc2Cl)C1

nearest known ligand 0.46

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 15/20 0.46
PDE4B Q07343 1/20 0.45
HPGDS O60760 1/20 0.43
CHEK2 O96017 1/20 0.43
PIK3CA P42336 2/20 0.42
PIK3CB P42338 2/20 0.42
PIK3CG P48736 2/20 0.42
GPR119 Q8TDV5 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
SCHEMBL30044661 1.00 PIK3CD (0.46) PIK3CDPDE4BHPGDSCHEK2PIK3CA
SCHEMBL23605796 0.84 PIK3CD (0.52) PIK3CDCHEK2PIK3CAPIK3CBPIK3CG
SCHEMBL23605456 0.83 PDE4B (0.47) PIK3CDPDE4BHPGDSCHEK2GPR119
SCHEMBL17418061 0.79 PDE4B (0.46) PIK3CDPDE4BHPGDSCHEK2PIK3CA
SCHEMBL17418062 0.79 PDE4B (0.46) PIK3CDPDE4BHPGDSCHEK2PIK3CA
SCHEMBL3133723 0.79 PIK3CD (0.56) PIK3CDPDE4BPIK3CAPIK3CBPIK3CG
SCHEMBL2457829 0.79 PIK3CD (0.56) PIK3CDPDE4BPIK3CAPIK3CBPIK3CG
SCHEMBL3134760 0.79 PIK3CD (0.56) PIK3CDPDE4BPIK3CAPIK3CBPIK3CG
SCHEMBL26668382 0.78 GPR119 (0.53) PIK3CDPDE4BCHEK2PIK3CAPIK3CB
SCHEMBL26665879 0.78 GPR119 (0.53) PIK3CDPDE4BCHEK2PIK3CAPIK3CB

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-2021133894-A1 BTK INHIBITORS BIOGEN MA INC. (US) 2021-07-01 WO disclosed