SCHEMBL754686

SCHEMBL754686

CC(=O)Nc1ccc(-c2ccc3nc(Nc4cc[nH]n4)c(-c4cc(N)nc(C)n4)n3n2)cc1

nearest known ligand 0.44

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.44
SMN1; SMN2 Q16637 3/20 0.44
MTOR P42345 10/20 0.42
PIK3CA P42336 9/20 0.42
FYN P06241 5/20 0.39
HTT P42858 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
XDH P47989 1/20 0.37
NPC1 O15118 1/20 0.37
ALDH1A1 P00352 1/20 0.37
HPGD P15428 1/20 0.37
RAB9A P51151 1/20 0.37

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
SCHEMBL754238 0.88 MTOR (0.40) KDM4ESMN1; SMN2MTORPIK3CAFYN
SCHEMBL751459 0.87 PIK3CA (0.42) MTORPIK3CAFYN
SCHEMBL2785811 0.85 PIK3CA (0.48) MTORPIK3CAFYN
SCHEMBL751467 0.83 PIK3CA (0.45) MTORPIK3CA
SCHEMBL753025 0.81 MTOR (0.50) KDM4ESMN1; SMN2MTORPIK3CA
SCHEMBL2789279 0.80 PIK3CA (0.43) KDM4ESMN1; SMN2MTORPIK3CA
SCHEMBL752822 0.77 FYN (0.45) KDM4ESMN1; SMN2MTORPIK3CAFYN
SCHEMBL753578 0.76 PIK3CA (0.40) MTORPIK3CA
SCHEMBL2791223 0.75 PIK3CA (0.42) MTORPIK3CA
SCHEMBL757233 0.75 PIK3CA (0.39) 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 KDM4E 1665/4885SMN1; SMN2 3999/4885MTOR 21/4885

“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.