SCHEMBL13620456

SCHEMBL13620456

CCNC(=O)Nc1cc(C(C)(C)C)on1

nearest known ligand 0.61

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
EGFR P00533 1/20 0.61
RAB9A P51151 3/20 0.61
KMT2A Q03164 3/20 0.61
MEN1 O00255 2/20 0.61
NPC1 O15118 2/20 0.61
MAPK14 Q16539 4/20 0.59
MAPT P10636 2/20 0.56
HTT P42858 2/20 0.56
NPSR1 Q6W5P4 1/20 0.56
RAF1 P04049 4/20 0.55
HPGD P15428 1/20 0.55
EPHX2 P34913 2/20 0.54
ATM Q13315 1/20 0.54
FLT3 P36888 2/20 0.53
GAA P10253 1/20 0.53
MAPK13 O15264 1/20 0.52
MAPK12 P53778 1/20 0.52
MAPK11 Q15759 1/20 0.52

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
SCHEMBL2951112 0.87 RAB9A (0.77) EGFRRAB9AKMT2AMEN1NPC1
SCHEMBL11646450 0.85 EGFR (0.59) EGFRRAB9AKMT2AMEN1NPC1
SCHEMBL11014875 0.85 RAB9A (0.62) EGFRRAB9AKMT2AMEN1NPC1
SCHEMBL11017752 0.84 EGFR (0.69) EGFRRAB9AKMT2AMEN1NPC1
SCHEMBL11016786 0.84 EGFR (0.57) EGFRRAB9AKMT2AMEN1NPC1
SCHEMBL11015930 0.82 EGFR (0.59) EGFRRAB9AKMT2AMEN1NPC1
SCHEMBL134635 0.82 RAB9A (0.66) EGFRRAB9AKMT2AMEN1NPC1
SCHEMBL4899524 0.82 RAB9A (0.66) EGFRRAB9AKMT2AMEN1NPC1
SCHEMBL4112548 0.82 EGFR (0.66) EGFRRAB9AKMT2AMEN1NPC1
SCHEMBL11035426 0.81 EGFR (0.66) EGFRRAB9AKMT2AMEN1NPC1

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-2183254-B1 INHIBITORS OF PROTEIN TYROSINE KINASE ACTIVITY METHYLGENE INC (CA) 2017-06-21 EP disclosed
US-8907091-B2 Processes and intermediates for preparing fused heterocyclic kinase inhibitors METHYLGENE INC. (CA) 2014-12-09 US disclosed
US-8846927-B2 Inhibitors of protein tyrosine kinase activity METHYLGENE INC. (CA) 2014-09-30 US disclosed
US-8569503-B2 Processes and intermediates for preparing fused heterocyclic kinase inhibitors METHYLGENE INC. (CA) 2013-10-29 US disclosed
US-20090286984-A1 Processes and intermediates for preparing fused heterocyclic kinase inhibitors Mirati Therapeutics, Inc. 2009-11-19 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-20090286984-A1 Processes and intermediates for preparing fused heterocyclic kinase inhibitors MAP3K19, MAP3K9, MAP4K2 EGFR 568/4885RAB9A 1119/4885KMT2A 938/4885

“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.