SCHEMBL751696

SCHEMBL751696

CNC(=O)c1ccc(-c2ccc3nc(Nc4ccn(C)n4)c(-c4cc(N)nc(C)n4)n3n2)cc1

nearest known ligand 0.50

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MTOR P42345 9/20 0.50
PIK3CA P42336 8/20 0.50
MET P08581 2/20 0.38
NPC1 O15118 1/20 0.36
RAB9A P51151 1/20 0.36
KLKB1 P03952 2/20 0.36
FYN P06241 3/20 0.35
TYK2 P29597 1/20 0.35
CSNK1D P48730 2/20 0.34
CSNK1E P49674 2/20 0.34

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
SCHEMBL751459 0.86 PIK3CA (0.42) MTORPIK3CAMETFYNCSNK1D
SCHEMBL2787352 0.85 MTOR (0.52) MTORPIK3CANPC1RAB9AKLKB1
SCHEMBL750591 0.83 MTOR (0.54) MTORPIK3CA
SCHEMBL16161668 0.82 PIK3CA (0.42) MTORPIK3CAMETFYNCSNK1D
SCHEMBL748975 0.81 MTOR (0.49) MTORPIK3CAMET
SCHEMBL751893 0.79 MTOR (0.47) MTORPIK3CA
SCHEMBL16161669 0.79 PIK3CA (0.37) MTORPIK3CAMETFYNCSNK1D
SCHEMBL749526 0.77 MTOR (0.55) MTORPIK3CACSNK1D
SCHEMBL751300 0.76 MTOR (0.72) MTORPIK3CA
SCHEMBL2786709 0.73 MTOR (0.65) MTORPIK3CANPC1RAB9A

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 MTOR 21/4885PIK3CA 1/4885MET 1484/4885

“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.