SCHEMBL757760

SCHEMBL757760

Cc1nc(N)nc(-c2c(Cl)nc3ccc(Br)cn23)n1

nearest known ligand 0.43

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PIK3CA P42336 18/20 0.43
MTOR P42345 18/20 0.43
PIK3CB P42338 1/20 0.39
GAA P10253 1/20 0.37
PIK3CD O00329 1/20 0.36
PIK3R1 P27986 1/20 0.36
MAP3K14 Q99558 1/20 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
SCHEMBL754305 0.78 PIK3CA (0.60) PIK3CAMTORPIK3CBGAA
SCHEMBL755344 0.78 PIK3CA (0.40) PIK3CAMTORGAAPIK3CDPIK3R1
SCHEMBL754934 0.77 PIK3CA (0.66) PIK3CAMTORPIK3CBPIK3CD
SCHEMBL751843 0.76 PIK3CA (0.43) PIK3CAMTORPIK3CBPIK3CD
SCHEMBL753757 0.75 GAA (0.38) PIK3CAMTORGAAPIK3CDPIK3R1
SCHEMBL755349 0.72 PIK3CA (0.42) PIK3CAMTORPIK3CBPIK3CD
SCHEMBL22519218 0.72 GAA (0.47) PIK3CAMTORGAA
SCHEMBL31547246 0.67 RXFP1 (0.48) PIK3CAMTORGAA
SCHEMBL24616873 0.66 TSHR (0.44) GAAMAP3K14
SCHEMBL754345 0.64 PIK3CA (0.45) PIK3CAMTORPIK3CBGAA

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 4 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 disclosed
US-20120190666-A1 Heteroaryl Compounds as PIKK Inhibitors AMGEN INC. (US) 2012-07-26 US disclosed
EP-2430013-A1 HETEROARYL COMPOUNDS AS PIKK INHIBITORS Amgen, Inc (US) 2012-03-21 EP disclosed
WO-2010132598-A1 HETEROARYL COMPOUNDS AS PIKK INHIBITORS AMGEN INC. (US) 2010-11-18 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-20120190666-A1 Heteroaryl Compounds as PIKK Inhibitors PIK3CA, PIKFYVE, PIK3CD PIK3CA 1/4885MTOR 21/4885PIK3CB 8/4885

“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.