SCHEMBL13976992

SCHEMBL13976992

Cc1cn2cc(-c3ccc4oc(N)nc4c3)ccc2n1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIK3CA P42336 17/20 0.46
PIK3CD O00329 3/20 0.46
PIK3CB P42338 3/20 0.46
PIK3CG P48736 3/20 0.46
MAPT P10636 2/20 0.43
LMNA P02545 1/20 0.43
CYP1A2 P05177 1/20 0.43
THRB P10828 1/20 0.43
ALOX15 P16050 1/20 0.43
MAPK1 P28482 1/20 0.43
MTOR P42345 3/20 0.42
RICTOR Q6R327 3/20 0.42
RPTOR Q8N122 3/20 0.42
MAPKAP1 Q9BPZ7 3/20 0.42
MLST8 Q9BVC4 3/20 0.42
FAAH O00519 1/20 0.42
KDM4E B2RXH2 1/20 0.41
NPC1 O15118 1/20 0.41
ALDH1A1 P00352 1/20 0.41
TP53 P04637 1/20 0.41

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
SCHEMBL13967496 0.86 PIK3CA (0.47) PIK3CAPIK3CDPIK3CBPIK3CGMAPT
SCHEMBL29011073 0.80 MAPT (0.53) PIK3CAPIK3CDPIK3CBPIK3CGMAPT
SCHEMBL30387174 0.80 MAPT (0.53) PIK3CAPIK3CDPIK3CBPIK3CGMAPT
SCHEMBL12927734 0.79 DYRK1A (0.62) PIK3CAPIK3CDPIK3CBPIK3CGMAPT
SCHEMBL12927788 0.79 PIK3CA (0.55) PIK3CAPIK3CDPIK3CBPIK3CG
SCHEMBL30385875 0.78 KDM4E (0.58) PIK3CAPIK3CDPIK3CBPIK3CGMAPT
SCHEMBL28914531 0.78 KDM4E (0.58) PIK3CAPIK3CDPIK3CBPIK3CGMAPT
SCHEMBL12850681 0.78 LMNA (0.66) PIK3CAPIK3CDPIK3CBPIK3CGMAPT
SCHEMBL12928187 0.76 PIK3CG (0.45) PIK3CAPIK3CDPIK3CBPIK3CGMAPT
SCHEMBL12927783 0.73 PIK3CA (0.48) PIK3CAPIK3CDPIK3CBPIK3CGMAPT

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-20120294930-A1 COMBINATION OF KINASE INHIBITORS AND USES THEREOF INTELLIKINE LLC (US) 2012-11-22 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-20120294930-A1 COMBINATION OF KINASE INHIBITORS AND USES THEREOF MTOR, AKT2, MTMR1 PIK3CA 6/4885PIK3CD 24/4885PIK3CB 17/4885

“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.