SCHEMBL17338237

SCHEMBL17338237

NCCCc1nc2cccc(Cl)c2c(=O)n1N1CCN(Cc2ccccc2)CC1

nearest known ligand 0.50

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 16/20 0.50
PIK3R2 O00459 10/20 0.50
PARP1 P09874 1/20 0.40
PARP2 Q9UGN5 1/20 0.40
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
SIGMAR1 Q99720 1/20 0.38
PDE4A P27815 1/20 0.38
PDE4B Q07343 1/20 0.38
PDE4C Q08493 1/20 0.38
PDE4D Q08499 1/20 0.38

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
SCHEMBL17338359 0.89 PIK3CD (0.52) PIK3CDPIK3R2SIGMAR1
SCHEMBL17338181 0.89 PIK3CD (0.53) PIK3CDPIK3R2SIGMAR1
SCHEMBL17338222 0.86 PIK3CD (0.47) PIK3CDPIK3R2MEN1KMT2A
SCHEMBL17338167 0.83 PIK3CD (0.48) PIK3CDPIK3R2MEN1KMT2A
SCHEMBL17338152 0.79 PIK3CD (0.50) PIK3CDPIK3R2
SCHEMBL17338385 0.79 PIK3CD (0.48) PIK3CDPIK3R2
SCHEMBL17338200 0.79 PIK3CD (0.54) PIK3CDPIK3R2
SCHEMBL20525273 0.79 PIK3CD (0.63) PIK3CDPIK3R2
SCHEMBL20525274 0.79 PIK3CD (0.63) PIK3CDPIK3R2
SCHEMBL17338314 0.79 PIK3CD (0.53) PIK3CDPIK3R2

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-3154958-A1 PHOSPHATIDYLINOSITOL 3-KINASE INHIBITORS Gilead Sciences, Inc. (US) 2017-04-19 EP disclosed
WO-2015191752-A1 PHOSPHATIDYLINOSITOL 3-KINASE INHIBITORS GILEAD SCIENCES, INC. (US) 2015-12-17 WO disclosed