SCHEMBL9959539

SCHEMBL9959539

Cc1c(Cl)c(F)c(C(C)Nc2ncnc3[nH]cnc23)c(-c2ccccc2)c1-c1nnn[nH]1

nearest known ligand 0.33

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 13/20 0.33
AXL P30530 1/20 0.33
MERTK Q12866 1/20 0.33
PIK3CB P42338 2/20 0.33
EGFR P00533 3/20 0.32
LMNA P02545 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
HSD17B10 Q99714 1/20 0.32
PIK3CA P42336 2/20 0.32
PIK3CG P48736 4/20 0.31

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
SCHEMBL9958646 0.80 PIK3CD (0.35) PIK3CDAXLMERTKPIK3CBEGFR
SCHEMBL9953267 0.80 PIK3CD (0.35) PIK3CDAXLMERTKPIK3CBEGFR
SCHEMBL9960561 0.78 PIK3CD (0.45) PIK3CDAXLMERTKPIK3CBPIK3CG
SCHEMBL9929302 0.78 PIK3CD (0.55) PIK3CDAXLMERTKPIK3CBPIK3CG
SCHEMBL21486193 0.75 PIK3CD (0.42) PIK3CDAXLMERTKPIK3CBEGFR
SCHEMBL21486180 0.75 PIK3CD (0.44) PIK3CDAXLMERTKPIK3CBPIK3CG
SCHEMBL9928820 0.75 PIK3CD (0.44) PIK3CDAXLMERTKPIK3CBPIK3CG
Trifluoroacetic Acid SCHEMBL21486179 0.75 PIK3CD (0.41) PIK3CDAXLMERTKPIK3CBPIK3CG
SCHEMBL9961003 0.72 PIK3CD (0.41) PIK3CDPIK3CBEGFRLMNASMN1; SMN2
SCHEMBL9929215 0.69 PIK3CD (0.50) PIK3CDAXLMERTKPIK3CBPIK3CA

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