SCHEMBL2786709

SCHEMBL2786709

CC(=O)Nc1ccc(-c2ccc3nc(Nc4ccn(C)n4)c(-c4cc(N)nc(C)n4)n3c2)cc1

nearest known ligand 0.65

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MTOR P42345 13/20 0.65
PIK3CA P42336 12/20 0.63
KDM4E B2RXH2 4/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
NPC1 O15118 2/20 0.37
RAB9A P51151 2/20 0.37
ALDH1A1 P00352 2/20 0.37
HPGD P15428 2/20 0.37
ADORA2A P29274 1/20 0.35
MAPT P10636 2/20 0.34
PKM P14618 1/20 0.34
XDH P47989 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
RXFP1 Q9HBX9 1/20 0.33
AKT1 P31749 1/20 0.33
AKT2 P31751 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
SCHEMBL2770611 0.84 MTOR (0.73) MTORPIK3CA
SCHEMBL754485 0.80 MTOR (0.54) MTORPIK3CA
SCHEMBL11028595 0.79 MTOR (0.76) MTORPIK3CA
SCHEMBL751976 0.78 PIK3CA (0.71) MTORPIK3CAADORA2A
SCHEMBL11030706 0.78 MTOR (0.55) MTORPIK3CA
SCHEMBL11030188 0.78 MTOR (1.00) MTORPIK3CAADORA2A
SCHEMBL751580 0.77 MTOR (0.71) MTORPIK3CA
SCHEMBL11029859 0.76 MTOR (0.74) MTORPIK3CA
SCHEMBL2787610 0.75 MTOR (1.00) MTORPIK3CANPC1RAB9AADORA2A
SCHEMBL2787352 0.75 MTOR (0.52) MTORPIK3CAKDM4ESMN1; SMN2NPC1

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 1/4885KDM4E 1665/4885

“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.