SCHEMBL23917478

SCHEMBL23917478

Cn1nc(-c2ccc3[nH]cnc3c2)c2c(N)ncnc21

nearest known ligand 0.65

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 18/20 0.65
PIK3CA P42336 18/20 0.65
PIK3CB P42338 18/20 0.65
PIK3CG P48736 18/20 0.65
PRKDC P78527 18/20 0.65
ABL1 P00519 16/20 0.65
EGFR P00533 16/20 0.65
HCK P08631 16/20 0.65
SRC P12931 16/20 0.65
MTOR P42345 16/20 0.65
EPHB4 P54760 16/20 0.65
KDR P35968 15/20 0.65
PI4KB Q9UBF8 4/20 0.59
NUDT14 O95848 1/20 0.53
NUDT5 Q9UKK9 1/20 0.53
RET P07949 1/20 0.47

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
SCHEMBL130528 0.81 PIK3CD (0.62) PIK3CDPIK3CAPIK3CBPIK3CGPRKDC
SCHEMBL129497 0.81 PIK3CD (0.83) PIK3CDPIK3CAPIK3CBPIK3CGPRKDC
SCHEMBL129822 0.79 PIK3CD (0.63) PIK3CDPIK3CAPIK3CBPIK3CGPRKDC
SCHEMBL130423 0.79 PIK3CD (1.00) PIK3CDPIK3CAPIK3CBPIK3CGPRKDC
SCHEMBL13201532 0.78 PIK3CD (0.70) PIK3CDPIK3CAPIK3CBPIK3CGPRKDC
SCHEMBL130759 0.78 PIK3CD (0.65) PIK3CDPIK3CAPIK3CBPIK3CGPRKDC
SCHEMBL16655510 0.78 ATR (0.68) PIK3CDPIK3CAPIK3CBPIK3CGPRKDC
SCHEMBL130513 0.77 SRC (0.79) PIK3CDPIK3CAPIK3CBPIK3CGPRKDC
SCHEMBL19299699 0.77 PIK3CD (0.62) PIK3CDPIK3CAPIK3CBPIK3CGPRKDC
SCHEMBL129501 0.77 PIK3CD (0.65) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210317140-A1 Heterocyclic Compounds and Methods of Use MEDIVATION TECHNOLOGIES, INC. (US) 2021-10-14 US 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-20210317140-A1 Heterocyclic Compounds and Methods of Use BTK, PIK3CD, PIK3CB PIK3CD 2/4885PIK3CA 6/4885PIK3CB 3/4885

“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.