SCHEMBL9960561

SCHEMBL9960561

Cc1c(Cl)c(F)c(C(C)Nc2ncnc3[nH]cnc23)c(-c2cccc(F)c2)c1-c1ccncc1

nearest known ligand 0.45

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 17/20 0.45
AXL P30530 2/20 0.45
MERTK Q12866 2/20 0.45
PIK3CG P48736 2/20 0.39
PIK3R1 P27986 1/20 0.39
PIK3CB P42338 1/20 0.39
BCL2 P10415 1/20 0.39
MAP4K4 O95819 1/20 0.39

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
Trifluoroacetic Acid SCHEMBL21486179 0.93 PIK3CD (0.41) PIK3CDAXLMERTKPIK3CGPIK3R1
SCHEMBL9928820 0.88 PIK3CD (0.44) PIK3CDAXLMERTKPIK3CGPIK3R1
SCHEMBL21486180 0.88 PIK3CD (0.44) PIK3CDAXLMERTKPIK3CGPIK3R1
SCHEMBL9960540 0.86 PIK3CD (0.47) PIK3CDAXLMERTKPIK3CGPIK3R1
SCHEMBL21986424 0.79 PIK3CD (0.41) PIK3CDAXLMERTKPIK3CGPIK3R1
SCHEMBL9959539 0.78 PIK3CD (0.33) PIK3CDAXLMERTKPIK3CGPIK3CB
SCHEMBL9928944 0.78 PIK3CD (0.50) PIK3CDAXLMERTKPIK3CGPIK3CB
SCHEMBL9958646 0.77 PIK3CD (0.35) PIK3CDAXLMERTKPIK3CGPIK3CB
SCHEMBL9929350 0.76 PIK3CD (0.46) PIK3CDAXLMERTKPIK3CGPIK3CB
SCHEMBL9953267 0.76 PIK3CD (0.35) PIK3CDAXLMERTKPIK3CGPIK3CB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2655374-A1 N-(1-(SUBSTITUTED-PHENYL)ETHYL)-9H-PURIN-6-AMINES AS PI3K INHIBITORS Incyte Corporation (US) 2013-10-30 EP claimed
WO-2012087881-A1 N-(1-(SUBSTITUTED-PHENYL)ETHYL)-9H-PURIN-6-AMINES AS PI3K INHIBITORS INCYTE CORPORATION (US) 2012-06-28 WO claimed
EP-2655374-A1 N-(1-(SUBSTITUTED-PHENYL)ETHYL)-9H-PURIN-6-AMINES AS PI3K INHIBITORS Incyte Corporation (US) 2013-10-30 EP disclosed
WO-2012087881-A1 N-(1-(SUBSTITUTED-PHENYL)ETHYL)-9H-PURIN-6-AMINES AS PI3K INHIBITORS INCYTE CORPORATION (US) 2012-06-28 WO disclosed