SCHEMBL758298

SCHEMBL758298

Cc1nc(Nc2cnn([C@@H]3CCOC3)c2)cc(-c2c(Nc3cc[nH]n3)nc3cccnn23)n1

nearest known ligand 0.77

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PIK3CA P42336 11/20 0.77
MTOR P42345 11/20 0.77
IRAK4 Q9NWZ3 2/20 0.34
FGFR2 P21802 1/20 0.34
FGFR3 P22607 1/20 0.34
JAK2 O60674 2/20 0.33
JAK1 P23458 2/20 0.33
JAK3 P52333 2/20 0.33
TGFBR1 P36897 1/20 0.33
RPS6KA2 Q15349 1/20 0.33
PTK2 Q05397 1/20 0.33
LRRK2 Q5S007 1/20 0.33
TYK2 P29597 1/20 0.33

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
SCHEMBL2790762 1.00 PIK3CA (0.77) PIK3CAMTORIRAK4FGFR2FGFR3
SCHEMBL752499 0.88 PIK3CA (0.60) PIK3CAMTORIRAK4JAK2JAK1
SCHEMBL756490 0.88 PIK3CA (0.60) PIK3CAMTORIRAK4JAK2JAK1
SCHEMBL2773798 0.81 PIK3CA (0.61) PIK3CAMTOR
SCHEMBL756343 0.80 PIK3CA (0.60) PIK3CAMTOR
SCHEMBL2772795 0.80 PIK3CA (0.72) PIK3CAMTOR
SCHEMBL754700 0.78 PIK3CA (0.51) PIK3CAMTORJAK2JAK1JAK3
SCHEMBL754194 0.78 PIK3CA (0.55) PIK3CAMTOR
SCHEMBL2789422 0.78 PIK3CA (0.59) PIK3CAMTOR
SCHEMBL2771543 0.77 PIK3CA (0.69) PIK3CAMTOR

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2430013-B1 HETEROARYL COMPOUNDS AS PIKK INHIBITORS AMGEN INC (US) 2014-10-15 EP claimed
US-20120190666-A1 Heteroaryl Compounds as PIKK Inhibitors AMGEN INC. (US) 2012-07-26 US claimed
EP-2430013-A1 HETEROARYL COMPOUNDS AS PIKK INHIBITORS Amgen, Inc (US) 2012-03-21 EP claimed
WO-2010132598-A1 HETEROARYL COMPOUNDS AS PIKK INHIBITORS AMGEN INC. (US) 2010-11-18 WO claimed
EP-2430013-B1 HETEROARYL COMPOUNDS AS PIKK INHIBITORS AMGEN INC (US) 2014-10-15 EP 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-20120190666-A1 Heteroaryl Compounds as PIKK Inhibitors PIK3CA, PIKFYVE, PIK3CD PIK3CA 1/4885MTOR 21/4885IRAK4 550/4885

“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.