SCHEMBL25725271

SCHEMBL25725271

CCC(O)N1CCC(c2ccn(-c3nc(N4CCOCC4)c4ncccc4n3)n2)CC1

nearest known ligand 0.42

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ PIK3CA P42336 18/20 0.42
▸ PIK3CD O00329 13/20 0.42
▸ PIK3CG P48736 12/20 0.42
▸ MTOR P42345 12/20 0.41
▸ PIK3R1 P27986 5/20 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
SCHEMBL25227992 0.86 PIK3CA (0.48) PIK3CAPIK3CDPIK3CGMTORPIK3R1
SCHEMBL25277713 0.85 PIK3CA (0.45) PIK3CAPIK3CDPIK3CGMTORPIK3R1
SCHEMBL30308905 0.82 PIK3CA (0.45) PIK3CAPIK3CDPIK3CGMTORPIK3R1
SCHEMBL25720157 0.82 PIK3CA (0.45) PIK3CAPIK3CDPIK3CGMTORPIK3R1
SCHEMBL30308860 0.80 GPR119 (0.45) PIK3CAPIK3CDPIK3CGMTORPIK3R1
SCHEMBL25720155 0.80 GPR119 (0.45) PIK3CAPIK3CDPIK3CGMTORPIK3R1
SCHEMBL25227750 0.79 PIK3CA (0.43) PIK3CAPIK3CDPIK3CGMTORPIK3R1
SCHEMBL25278157 0.78 PIK3CA (0.43) PIK3CAPIK3CDPIK3CGMTORPIK3R1
SCHEMBL30308875 0.77 PIK3CA (0.41) PIK3CAPIK3CDPIK3CGMTORPIK3R1
SCHEMBL27271080 0.77 PIK3CA (0.41) PIK3CAPIK3CDPIK3CGMTORPIK3R1

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-2023107592-A1 PYRIDOPYRIMIDINES AND METHODS OF THEIR USE Kineta, Inc. (US) 2023-06-15 — — WO disclosed
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