SCHEMBL24096482

SCHEMBL24096482

Cc1nn(-c2ccncc2)c2ncnc(N)c12

nearest known ligand 0.55

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ PIK3CD O00329 13/20 0.55
▸ PIK3CB P42338 5/20 0.55
▸ PIK3CG P48736 1/20 0.55
▸ SRC P12931 2/20 0.51
▸ EGFR P00533 2/20 0.51
▸ KDM4E B2RXH2 1/20 0.46
▸ GSK3B P49841 2/20 0.42
▸ XDH P47989 1/20 0.42

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
SCHEMBL24096486 0.83 SRC (0.50) PIK3CDPIK3CBPIK3CGSRCEGFR
SCHEMBL14617706 0.75 CSF1R (0.42) PIK3CDPIK3CBPIK3CGSRCEGFR
SCHEMBL29042116 0.73 PIK3CD (1.00) PIK3CDPIK3CBPIK3CG
SCHEMBL29638715 0.73 PIK3CD (1.00) PIK3CDPIK3CBPIK3CG
SCHEMBL23997145 0.73 SRC (0.55) PIK3CDPIK3CBPIK3CGSRCEGFR
SCHEMBL30320501 0.73 SRC (0.55) PIK3CDPIK3CBPIK3CGSRCEGFR
SCHEMBL3716785 0.72 EGFR (0.72) SRCEGFRKDM4E
SCHEMBL4826570 0.72 SRC (0.67) PIK3CDPIK3CBPIK3CGSRCEGFR
SCHEMBL23057484 0.71 EGFR (0.42) PIK3CDPIK3CBPIK3CGSRCEGFR
SCHEMBL10260251 0.71 PIK3CD (0.52) PIK3CDPIK3CBPIK3CGSRCEGFR

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-2021252488-A1 INHIBITORS OF NEK7 KINASE Halia Therapeutics, Inc. (US) 2021-12-16 — — WO disclosed
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