SCHEMBL20142878

SCHEMBL20142878

N#Cc1n[nH]c2ncnc(N)c12.[NaH]

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 8/20 0.38
PIK3CA P42336 8/20 0.38
PIK3CB P42338 8/20 0.38
PIK3CG P48736 8/20 0.38
PRKDC P78527 8/20 0.38
LRRK2 Q5S007 6/20 0.38
SGK1 O00141 1/20 0.37
MEN1 O00255 1/20 0.37
DYRK3 O43781 1/20 0.37
EIF4E P06730 1/20 0.37
EIF2AK2 P19525 1/20 0.37
MTOR P42345 1/20 0.37
CSNK1D P48730 1/20 0.37
KMT2A Q03164 1/20 0.37
BRSK2 Q8IWQ3 1/20 0.37
AURKB Q96GD4 1/20 0.37
MKNK1 Q9BUB5 1/20 0.37
MKNK2 Q9HBH9 1/20 0.37
ABL1 P00519 2/20 0.36
SRC P12931 2/20 0.36

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
SCHEMBL1845744 0.98 PIK3CD (0.39) PIK3CDPIK3CAPIK3CBPIK3CGPRKDC
SCHEMBL26789959 0.80 PIK3CD (0.39) PIK3CDPIK3CAPIK3CBPIK3CGPRKDC
SCHEMBL4725800 0.79 CHEK1 (0.40) ABL1SRC
SCHEMBL4725741 0.79
SCHEMBL887796 0.77 PIK3CD (0.41) PIK3CDPIK3CAPIK3CBPIK3CGPRKDC
SCHEMBL887848 0.75 PIK3CD (0.36) PIK3CDPIK3CAPIK3CBPIK3CGPRKDC
SCHEMBL28508442 0.74 RET (0.43) PIK3CDPIK3CAPIK3CBPIK3CGPRKDC
SCHEMBL887826 0.73 AHCY (0.38) PIK3CDPIK3CAPIK3CBPIK3CGPRKDC
SCHEMBL8325672 0.72 KDM4E (0.45) PIK3CDPIK3CAPIK3CBPIK3CGPRKDC
SCHEMBL19260192 0.72 RET (0.50) PIK3CDPIK3CAPIK3CBPIK3CGPRKDC

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
US-10865208-B2 ATG7 inhibitors and the uses thereof MILLENNIUM PHARMACEUTICALS, INC. (US) 2020-12-15 US disclosed
WO-2018089786-A1 ATG7 INHIBITORS AND THE USES THEREOF MILLENNIUM PHARMACEUTICALS, INC. (US) 2018-05-17 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-10865208-B2 ATG7 inhibitors and the uses thereof ATG7, BECN1, SQSTM1 PIK3CD 279/4885PIK3CA 171/4885PIK3CB 241/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.