SCHEMBL21028679

SCHEMBL21028679

Cc1ncnc2c1c(-c1cccc(O)c1)nn2Cc1nc2scc(C)c2c(=O)n1-c1ccccc1F

nearest known ligand 0.58

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 19/20 0.58
PIK3CG P48736 7/20 0.58
PIK3CA P42336 5/20 0.58
PIK3CB P42338 5/20 0.58
ABL1 P00519 1/20 0.58
SRC P12931 1/20 0.58
MTOR P42345 1/20 0.58
PRKDC P78527 1/20 0.58

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
SCHEMBL12895090 0.93 PIK3CD (0.69) PIK3CDPIK3CGPIK3CAPIK3CBABL1
SCHEMBL1261217 0.87 PIK3CD (0.78) PIK3CDPIK3CGPIK3CAPIK3CBABL1
SCHEMBL12895130 0.85 PIK3CD (0.69) PIK3CDPIK3CGPIK3CAPIK3CBABL1
SCHEMBL12895091 0.85 PIK3CD (0.65) PIK3CDPIK3CGPIK3CAPIK3CBABL1
SCHEMBL12895084 0.85 PIK3CD (0.71) PIK3CDPIK3CGPIK3CAPIK3CBABL1
SCHEMBL12895075 0.85 PIK3CD (0.68) PIK3CDPIK3CGPIK3CAPIK3CBABL1
SCHEMBL12895119 0.84 PIK3CD (0.66) PIK3CDPIK3CGPIK3CAPIK3CBABL1
SCHEMBL12895085 0.84 PIK3CD (0.64) PIK3CDPIK3CGPIK3CAPIK3CBABL1
SCHEMBL12895087 0.84 PIK3CD (0.72) PIK3CDPIK3CGPIK3CAPIK3CBABL1
SCHEMBL12895129 0.83 PIK3CD (0.67) PIK3CDPIK3CGPIK3CAPIK3CBABL1

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-3613743-A1 PROCESSES FOR THE PREPARATION OF 1H-PYRAZOLO[3,4-D]PYRIMIDIN-4-AMINE DERIVATIVES Intellikine, LLC (US) 2020-02-26 EP disclosed
EP-2240452-B1 1H-PYRAZOLO[3,4-D]PYRIMIDIN-4-AMINE DERIVATIVES AS PI3 KINASE MODULATORS, THEIR COMPOSITIONS AND USES INTELLIKINE LLC (US) 2019-05-29 EP disclosed