SCHEMBL6926807

SCHEMBL6926807

CCc1nn(CCO)c2ncnc(N)c12

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PIK3CD O00329 6/20 0.52
▸ SRC P12931 5/20 0.52
▸ PRKDC P78527 4/20 0.52
▸ PIK3CG P48736 4/20 0.52
▸ PIK3CB P42338 4/20 0.52
▸ PIK3CA P42336 3/20 0.52
▸ ABL1 P00519 2/20 0.52
▸ EGFR P00533 2/20 0.52
▸ HCK P08631 2/20 0.52
▸ KDR P35968 2/20 0.52
▸ MTOR P42345 2/20 0.52
▸ EPHB4 P54760 2/20 0.52
▸ PI4KB Q9UBF8 2/20 0.52
▸ ADORA2A P29274 3/20 0.43
▸ ADORA1 P30542 2/20 0.43
▸ RET P07949 3/20 0.41
▸ ATG7 O95352 1/20 0.41
▸ ADORA2B P29275 1/20 0.40
▸ YES1 P07947 1/20 0.39
▸ FGR P09769 1/20 0.39

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
SCHEMBL10261070 0.83 SRC (0.52) PIK3CDSRCPRKDCPIK3CGPIK3CB
SCHEMBL27943325 0.82 PIK3CD (0.40) PIK3CDSRCPRKDCPIK3CGPIK3CB
SCHEMBL14647490 0.80 PIK3CD (0.47) PIK3CDSRCPRKDCPIK3CGPIK3CB
SCHEMBL868521 0.79 DYRK3 (0.51) PIK3CDSRCPRKDCPIK3CGPIK3CB
SCHEMBL19476278 0.79 ADORA2A (0.49) PIK3CDSRCPRKDCPIK3CGPIK3CB
SCHEMBL6929476 0.78 PIK3CD (0.48) PIK3CDSRCPRKDCPIK3CGPIK3CB
SCHEMBL29780889 0.73 SRC (0.64) PIK3CDSRCPRKDCPIK3CGPIK3CB
SCHEMBL12758 0.72 ADORA2A (0.46) PIK3CDSRCPRKDCPIK3CGPIK3CB
SCHEMBL29052149 0.70 ADORA2A (0.49) PIK3CDSRCPRKDCPIK3CGPIK3CB
SCHEMBL29781034 0.70 ADORA2A (0.49) PIK3CDSRCPRKDCPIK3CGPIK3CB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2011119663-A1 CHEMICAL COMPOUNDS GLAXOSMITHKLINE LLC (US) 2011-09-29 — — WO disclosed
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