SCHEMBL28952186

SCHEMBL28952186

CCOc1c(C(C)=O)cc(Cl)c(C)c1C1CNC(=O)C1

nearest known ligand 0.51

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 13/20 0.51
KCNH2 Q12809 1/20 0.42
PDE4A P27815 7/20 0.41
PDE4B Q07343 3/20 0.40
PDE4C Q08493 3/20 0.40
PDE4D Q08499 3/20 0.40

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
SCHEMBL30276037 1.00 PIK3CD (0.51) PIK3CDKCNH2PDE4APDE4BPDE4C
SCHEMBL28952681 0.88 PIK3CD (0.49) PIK3CDKCNH2PDE4APDE4BPDE4C
SCHEMBL30276072 0.88 PIK3CD (0.49) PIK3CDKCNH2PDE4APDE4BPDE4C
SCHEMBL18038546 0.88 PIK3CD (0.51) PIK3CDKCNH2PDE4APDE4BPDE4C
SCHEMBL30276043 0.88 PIK3CD (0.51) PIK3CDKCNH2PDE4APDE4BPDE4C
SCHEMBL28964731 0.88 PIK3CD (0.51) PIK3CDKCNH2PDE4APDE4BPDE4C
SCHEMBL14736652 0.88 PIK3CD (0.51) PIK3CDKCNH2PDE4APDE4BPDE4C
SCHEMBL14736487 0.85 PIK3CD (0.53) PIK3CDKCNH2PDE4APDE4BPDE4C
SCHEMBL30276021 0.80 PIK3CD (0.62) PIK3CDKCNH2PDE4APDE4BPDE4C
SCHEMBL28952539 0.80 PIK3CD (0.62) PIK3CDKCNH2PDE4APDE4BPDE4C

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
CN-115703770-A Pyrimidinamine compound and composition and application thereof 深圳范恩柯尔精准医疗有限公司 2023-02-17 CN disclosed