SCHEMBL14746291

SCHEMBL14746291

COc1c(C(C)O)cc(Cl)c(C)c1C1CCN(C(C)(C)C)CC1

nearest known ligand 0.45

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 12/20 0.45
AXL P30530 2/20 0.30
MERTK Q12866 2/20 0.30

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
SCHEMBL14736678 0.83 MAPT (0.43) PIK3CD
SCHEMBL14736001 0.83 PIK3CD (0.44) PIK3CD
SCHEMBL14742470 0.79 PIK3CD (0.35) PIK3CD
SCHEMBL14753976 0.78 PIK3CD (0.41) PIK3CDAXLMERTK
SCHEMBL14736186 0.78 PIK3CD (0.41) PIK3CDAXLMERTK
SCHEMBL14736738 0.76 PIK3CD (0.41) PIK3CD
SCHEMBL14736290 0.75 PIK3CD (0.42) PIK3CDAXLMERTK
SCHEMBL14736911 0.74 MAPT (0.46) PIK3CD
SCHEMBL14736413 0.74 PIK3CD (0.44) PIK3CD
SCHEMBL9928833 0.73 PIK3CD (0.43) PIK3CD

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-2751109-A1 HETEROCYCLYLAMINES AS PI3K INHIBITORS Incyte Corporation (US) 2014-07-09 EP disclosed
WO-2013033569-A1 HETEROCYCLYLAMINES AS PI3K INHIBITORS INCYTE CORPORATION (US) 2013-03-07 WO disclosed