SCHEMBL30140176

SCHEMBL30140176

CC(C)(C)OC(=O)N1CC[C@H](Oc2ccc3ncnc(O)c3n2)C1

nearest known ligand 0.54

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 20/20 0.54
PIK3CA P42336 2/20 0.53
PIK3CB P42338 2/20 0.53
PIK3CG P48736 2/20 0.53

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
SCHEMBL23537918 0.89 PIK3CD (0.52) PIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL23537917 0.89 PIK3CD (0.52) PIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL30140061 0.86 PIK3CD (0.53) PIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL30140379 0.86 PIK3CD (0.53) PIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL30640019 0.82 GPR119 (0.49)
SCHEMBL26109771 0.82 GPR119 (0.49)
SCHEMBL30140100 0.82 PIK3CD (0.55) PIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL23537987 0.81 PIK3CD (0.61) PIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL23537986 0.81 PIK3CD (0.61) PIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL23570262 0.81 PIK3CD (0.51) PIK3CDPIK3CAPIK3CBPIK3CG

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
WO-2022266427-A1 4-(ARYL-METHYL-AMINO)-QUINAZOLINE DERIVATIVES AND USES THEREOF BLACK DIAMOND THERAPEUTICS, INC. (US) 2022-12-22 WO disclosed
WO-2022266426-A1 6-(HETEROCYCLOALKYL-OXY)-QUINAZOLINE DERIVATIVES AND USES THEREOF BLACK DIAMOND THERAPEUTICS, INC. (US) 2022-12-22 WO disclosed