SCHEMBL30397149

SCHEMBL30397149

CC(=O)c1c(Cl)ncnc1N[C@@H](C)c1cc2cccc(Cl)c2c(=O)n1-c1ccccc1

nearest known ligand 0.66

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 19/20 0.66
PIK3CG P48736 16/20 0.66
PIK3R1 P27986 10/20 0.66
PIK3CB P42338 4/20 0.66
PIK3CA P42336 3/20 0.66
ABCB11 O95342 1/20 0.66
TBXA2R P21731 1/20 0.66
HTR2A P28223 1/20 0.66
PDE3A Q14432 1/20 0.66
PIK3R2 O00459 3/20 0.52

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
SCHEMBL25397267 1.00 PIK3CD (0.66) PIK3CDPIK3CGPIK3R1PIK3CBPIK3CA
SCHEMBL25397266 1.00 PIK3CD (0.66) PIK3CDPIK3CGPIK3R1PIK3CBPIK3CA
SCHEMBL28572749 0.83 PIK3CD (0.55) PIK3CDPIK3CGPIK3R1PIK3CBPIK3CA
SCHEMBL20061376 0.83 PIK3CD (0.55) PIK3CDPIK3CGPIK3R1PIK3CBPIK3CA
SCHEMBL30396632 0.83 PIK3CD (0.52) PIK3CDPIK3CGPIK3R1PIK3CBPIK3CA
SCHEMBL25396151 0.83 PIK3CD (0.52) PIK3CDPIK3CGPIK3R1PIK3CBPIK3CA
SCHEMBL25396153 0.83 PIK3CD (0.52) PIK3CDPIK3CGPIK3R1PIK3CBPIK3CA
SCHEMBL14726428 0.83 PIK3CD (0.65) PIK3CDPIK3CGPIK3R1PIK3CBPIK3CA
SCHEMBL26246722 0.83 PIK3CG (0.53) PIK3CDPIK3CGPIK3R1PIK3CBPIK3CA
SCHEMBL12688634 0.82 PIK3CD (0.69) PIK3CDPIK3CGPIK3R1PIK3CBPIK3CA

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-115968369-A Process for the preparation of compounds as PI3K inhibitors and intermediate compounds useful for the preparation thereof 株式会社保宁 2023-04-14 CN disclosed