SCHEMBL2786752

SCHEMBL2786752

CCNC(=O)Nc1ccc(Nc2nc3ccccn3c2-c2cc(NC(C)=O)nc(C)n2)cc1

nearest known ligand 0.66

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MTOR P42345 12/20 0.66
PIK3CA P42336 11/20 0.66
USP7 Q93009 1/20 0.42
LMNA P02545 1/20 0.42
GLA P06280 1/20 0.42
CCNE1 P24864 2/20 0.40
CDK2 P24941 2/20 0.40
KDM4E B2RXH2 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
HSD17B10 Q99714 1/20 0.40
CDK4 P11802 1/20 0.40
MAPT P10636 1/20 0.39

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
SCHEMBL2775861 0.88 PIK3CA (0.56) MTORPIK3CAUSP7LMNAGLA
SCHEMBL752472 0.81 PIK3CA (0.54) MTORPIK3CACCNE1CDK2KDM4E
SCHEMBL2773726 0.80 PIK3CA (0.51) MTORPIK3CACCNE1CDK2KDM4E
SCHEMBL2787610 0.80 MTOR (1.00) MTORPIK3CAUSP7LMNAGLA
SCHEMBL2772137 0.79 PIK3CA (0.54) MTORPIK3CACCNE1CDK2KDM4E
SCHEMBL752556 0.79 MTOR (0.72) MTORPIK3CAUSP7LMNAGLA
SCHEMBL2790005 0.79 PIK3CA (0.62) MTORPIK3CACCNE1CDK2NPSR1
SCHEMBL11028397 0.78 PIK3CA (0.59) MTORPIK3CAUSP7LMNAGLA
SCHEMBL751862 0.78 PIK3CA (0.56) MTORPIK3CAKDM4ENPSR1HSD17B10
SCHEMBL2771022 0.76 PIK3CA (0.62) MTORPIK3CAUSP7CCNE1CDK2

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 claimed
US-20120190666-A1 Heteroaryl Compounds as PIKK Inhibitors AMGEN INC. (US) 2012-07-26 US 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 MTOR 21/4885PIK3CA 1/4885USP7 3522/4885

“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.