SCHEMBL21179277

SCHEMBL21179277

CC(NC(=O)OC(C)(C)C)c1nc2cccc(C#CCO)c2c(=O)n1C1CC1

nearest known ligand 0.48

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 20/20 0.48
PIK3CG P48736 3/20 0.48
PIK3R1 P27986 2/20 0.48
PIK3R2 O00459 11/20 0.42
PIK3CA P42336 1/20 0.42

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
SCHEMBL21174690 0.87 PIK3CD (0.54) PIK3CDPIK3CGPIK3R1PIK3R2PIK3CA
SCHEMBL18056720 0.87 PIK3CD (0.53) PIK3CDPIK3CGPIK3R2
SCHEMBL28968355 0.81 PIK3CD (0.49) PIK3CDPIK3CGPIK3R2
SCHEMBL30418978 0.81 PIK3CD (0.49) PIK3CDPIK3CGPIK3R2
SCHEMBL21174812 0.80 PIK3CD (0.53) PIK3CDPIK3CGPIK3R1PIK3R2PIK3CA
SCHEMBL21174810 0.80 PIK3CD (0.53) PIK3CDPIK3CGPIK3R1PIK3R2PIK3CA
SCHEMBL28968385 0.80 PIK3CD (0.60) PIK3CDPIK3CGPIK3R2
SCHEMBL30418541 0.80 PIK3CD (0.60) PIK3CDPIK3CGPIK3R2
SCHEMBL16663361 0.79 PIK3CD (0.45) PIK3CDPIK3CGPIK3R1PIK3CA
SCHEMBL28968392 0.79 PIK3CD (0.44) PIK3CDPIK3CGPIK3R2

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3740468-A1 SUBSTITUTED AMINOPYRIMIDINE COMPOUNDS AND METHODS OF USE Sunshine Lake Pharma Co., Ltd. (CN) 2020-11-25 EP disclosed
WO-2019143874-A1 SUBSTITUTED AMINOPYRIMIDINE COMPOUNDS AND METHODS OF USE SUNSHINE LAKE PHARMA CO., LTD. (CN) 2019-07-25 WO disclosed