SCHEMBL30822706

SCHEMBL30822706

Cc1cc(-n2c([C@H](C)N)cc3c(F)ccc(Cl)c3c2=O)n[nH]1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 10/20 0.35
PIK3CB P42338 6/20 0.35
SYK P43405 2/20 0.33
PIK3CG P48736 2/20 0.33
CHEK1 O14757 3/20 0.32
KDM4E B2RXH2 1/20 0.31
MEN1 O00255 1/20 0.31
NPC1 O15118 1/20 0.31
ALDH1A1 P00352 1/20 0.31
LMNA P02545 1/20 0.31
ALOX12 P18054 1/20 0.31
HTT P42858 1/20 0.31
RAB9A P51151 1/20 0.31
KMT2A Q03164 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
NTRK1 P04629 2/20 0.30
ALK Q9UM73 2/20 0.30
CSF1R P07333 1/20 0.30

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
SCHEMBL29164749 1.00 PIK3CD (0.35) PIK3CDPIK3CBSYKPIK3CGCHEK1
SCHEMBL29164747 1.00 PIK3CD (0.35) PIK3CDPIK3CBSYKPIK3CGCHEK1
SCHEMBL29164788 0.84 PIK3CD (0.35) PIK3CDPIK3CBPIK3CGPIK3R1PIK3CA
SCHEMBL29164791 0.84 PIK3CD (0.35) PIK3CDPIK3CBPIK3CGPIK3R1PIK3CA
SCHEMBL30822648 0.84 PIK3CD (0.35) PIK3CDPIK3CBPIK3CGPIK3R1PIK3CA
SCHEMBL30822729 0.81 PIK3CD (0.40) PIK3CDPIK3CBPIK3CGPIK3R1PIK3CA
SCHEMBL29164550 0.81 PIK3CD (0.40) PIK3CDPIK3CBPIK3CGPIK3R1PIK3CA
SCHEMBL29164551 0.81 PIK3CD (0.40) PIK3CDPIK3CBPIK3CGPIK3R1PIK3CA
SCHEMBL14649467 0.78 PIK3CD (0.43) PIK3CDPIK3CBPIK3CGKDM4EPIK3R1
SCHEMBL29164734 0.78 PIK3CD (0.37) PIK3CDPIK3CBSYKPIK3CGKDM4E

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-117659001-A Aminopyrimidine derivatives and their use in medicine 广东东阳光药业股份有限公司 2024-03-08 CN disclosed