SCHEMBL5607754

SCHEMBL5607754

Cc1cccc2nc(CCNc3nc(N)nc4[nH]cnc34)n(-c3ccccc3)c(=O)c12

nearest known ligand 0.48

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 15/20 0.48
PIK3R1 P27986 6/20 0.48
PIK3CG P48736 7/20 0.42
PIK3CB P42338 5/20 0.42
PIK3CA P42336 4/20 0.42
NUDT1 P36639 1/20 0.37

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
SCHEMBL5607763 0.95 PIK3CD (0.47) PIK3CDPIK3R1PIK3CGPIK3CBPIK3CA
SCHEMBL5607593 0.93 PIK3CD (0.41) PIK3CDPIK3R1PIK3CGPIK3CBPIK3CA
SCHEMBL5606889 0.93 PIK3CD (0.41) PIK3CDPIK3R1PIK3CGPIK3CBPIK3CA
SCHEMBL5607928 0.92 PIK3CG (0.41) PIK3CDPIK3R1PIK3CGPIK3CBPIK3CA
SCHEMBL5607509 0.91 PIK3CD (0.56) PIK3CDPIK3R1PIK3CGPIK3CBPIK3CA
SCHEMBL4764454 0.91 PIK3CD (0.49) PIK3CDPIK3R1PIK3CGPIK3CBPIK3CA
SCHEMBL5607427 0.91 PIK3CD (0.44) PIK3CDPIK3R1PIK3CGPIK3CBPIK3CA
SCHEMBL5259222 0.91 PIK3CD (0.40) PIK3CDPIK3R1PIK3CGPIK3CBPIK3CA
SCHEMBL5607940 0.91 PIK3CD (0.47) PIK3CDPIK3R1PIK3CGPIK3CB
SCHEMBL5607167 0.90 PIK3CD (0.45) PIK3CDPIK3R1PIK3CGPIK3CBPIK3CA

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-1750715-A1 METHODS FOR TREATING MAST CELL DISORDERS ICOS CORPORATION (US) 2007-02-14 EP disclosed
WO-2005120511-A1 METHODS FOR TREATING MAST CELL DISORDERS ICOS CORPORATION (US) 2005-12-22 WO disclosed