SCHEMBL14655830

SCHEMBL14655830

NC(=O)Cn1nc(-c2ccc3ccccc3c2)c2c(N)ncnc21

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ PIK3CD O00329 14/20 1.00
▸ PRKDC P78527 13/20 1.00
▸ PIK3CA P42336 10/20 1.00
▸ PIK3CB P42338 10/20 1.00
▸ PIK3CG P48736 10/20 1.00
▸ SRC P12931 5/20 0.63
▸ ABL1 P00519 3/20 0.63
▸ MTOR P42345 2/20 0.63
▸ EGFR P00533 2/20 0.63
▸ KDR P35968 2/20 0.63
▸ HCK P08631 1/20 0.63
▸ EPHB4 P54760 1/20 0.63
▸ HDAC1 Q13547 1/20 0.51
▸ RET P07949 1/20 0.50

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
SCHEMBL30386838 1.00 PIK3CD (1.00) PIK3CDPRKDCPIK3CAPIK3CBPIK3CG
SCHEMBL30385963 0.84 PIK3CD (1.00) PIK3CDPRKDCPIK3CAPIK3CBPIK3CG
SCHEMBL21048473 0.84 PIK3CD (1.00) PIK3CDPRKDCPIK3CAPIK3CBPIK3CG
SCHEMBL30387188 0.82 PIK3CD (1.00) PIK3CDPRKDCPIK3CAPIK3CBPIK3CG
SCHEMBL30387571 0.81 PIK3CD (1.00) PIK3CDPRKDCPIK3CAPIK3CBPIK3CG
SCHEMBL30387431 0.81 PIK3CD (1.00) PIK3CDPRKDCPIK3CAPIK3CBPIK3CG
SCHEMBL5136625 0.80 PIK3CD (1.00) PIK3CDPRKDCPIK3CAPIK3CBPIK3CG
SCHEMBL30387215 0.80 PIK3CD (1.00) PIK3CDPRKDCPIK3CAPIK3CBPIK3CG
SCHEMBL30386831 0.80 PIK3CD (1.00) PIK3CDPRKDCPIK3CAPIK3CBPIK3CG
SCHEMBL5065412 0.80 PIK3CD (1.00) PIK3CDPRKDCPIK3CAPIK3CBPIK3CG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101506211-B Kinase antagonists UNIV CALIFORNIA 2013-05-22 — — CN disclosed
EP-2551270-A2 PYRAZOLOPYRMIDINE DERIVATIVES FOR USE AS PI3 KINASE ANTAGONISTS The Regents of The University of California (US) 2013-01-30 — — EP disclosed
CN-101506211-A Kinase antagonists UNIV CALIFORNIA (US) 2009-08-12 — — CN disclosed
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