SCHEMBL11030188

SCHEMBL11030188

CC(=O)Nc1cc(-c2c(Nc3ccn(C)n3)nc3ccc(-c4cccnc4C)cn23)nc(C)n1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MTOR P42345 12/20 1.00
PIK3CA P42336 11/20 1.00
TGFBR1 P36897 4/20 0.41
CSNK1D P48730 1/20 0.35
CSNK1E P49674 1/20 0.35
ADORA2A P29274 1/20 0.35
ADORA1 P30542 1/20 0.35
CREBBP Q92793 1/20 0.34
PDE10A Q9Y233 1/20 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
SCHEMBL11028595 0.86 MTOR (0.76) MTORPIK3CA
SCHEMBL751976 0.83 PIK3CA (0.71) MTORPIK3CAADORA2AADORA1
SCHEMBL2787610 0.81 MTOR (1.00) MTORPIK3CACSNK1DCSNK1EADORA2A
SCHEMBL11029859 0.80 MTOR (0.74) MTORPIK3CA
SCHEMBL2787359 0.78 MTOR (1.00) MTORPIK3CAADORA2AADORA1
SCHEMBL2786709 0.78 MTOR (0.65) MTORPIK3CAADORA2A
SCHEMBL753664 0.77 MTOR (0.74) MTORPIK3CATGFBR1ADORA2AADORA1
SCHEMBL756258 0.75 MTOR (0.65) MTORPIK3CAADORA2AADORA1
SCHEMBL761701 0.73 MTOR (0.62) MTORPIK3CACSNK1DCSNK1E
SCHEMBL16161627 0.73 MTOR (0.65) MTORPIK3CAADORA2AADORA1

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
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

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 1/4885TGFBR1 3147/4885

“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.