SCHEMBL23917211

SCHEMBL23917211

Nc1ccc(-c2nn(CCC3CCc4ccccc4C3)c3ncnc(N)c23)cc1O

nearest known ligand 0.55

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 14/20 0.55
SRC P12931 8/20 0.55
PIK3CA P42336 7/20 0.55
PIK3CG P48736 7/20 0.55
PIK3CB P42338 6/20 0.55
PRKDC P78527 6/20 0.55
ABL1 P00519 5/20 0.55
EGFR P00533 5/20 0.55
HCK P08631 5/20 0.55
KDR P35968 5/20 0.55
MTOR P42345 5/20 0.55
EPHB4 P54760 5/20 0.55
PI4KB Q9UBF8 5/20 0.55
BTK Q06187 7/20 0.51
ATR Q13535 3/20 0.51
TGFBR1 P36897 1/20 0.48

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
SCHEMBL23917484 0.88 PIK3CD (0.50) PIK3CDSRCPIK3CAPIK3CGPIK3CB
SCHEMBL23917538 0.83 FYN (0.57) PIK3CDSRCPIK3CAPIK3CGPIK3CB
SCHEMBL23917452 0.82 PIK3CD (0.55) PIK3CDSRCPIK3CAPIK3CGPIK3CB
SCHEMBL16655620 0.82 PIK3CD (0.74) PIK3CDSRCPIK3CAPIK3CGPIK3CB
SCHEMBL23917469 0.78 PIK3CD (0.45) PIK3CDSRCPIK3CAPIK3CGPIK3CB
SCHEMBL16655246 0.75 PIK3CD (0.75) PIK3CDSRCPIK3CAPIK3CGPIK3CB
SCHEMBL16655979 0.73 PIK3CD (0.89) PIK3CDSRCPIK3CAPIK3CGPIK3CB
SCHEMBL16655560 0.73 PIK3CD (0.89) PIK3CDSRCPIK3CAPIK3CGPIK3CB
SCHEMBL16655609 0.73 PIK3CD (0.89) PIK3CDSRCPIK3CAPIK3CGPIK3CB
SCHEMBL16655507 0.73 PIK3CD (0.89) PIK3CDSRCPIK3CAPIK3CGPIK3CB

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 2/4885SRC 92/4885PIK3CA 6/4885

“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.