SCHEMBL2061707

SCHEMBL2061707

CCCN1CCc2cc(Nc3ncc(Cl)c(N[C@H]4[C@@H](C(N)=O)[C@@H]5C=C[C@H]4C5)n3)c(OC)cc2CC1

nearest known ligand 0.76

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALK Q9UM73 16/20 0.76
INSR P06213 8/20 0.69
KDR P35968 4/20 0.57
AURKB Q96GD4 4/20 0.57
PTK2 Q05397 3/20 0.57
NUAK1 O60285 1/20 0.57
CHEK2 O96017 1/20 0.57
FES P07332 1/20 0.57
FER P16591 1/20 0.57
FLT4 P35916 1/20 0.57
FLT3 P36888 1/20 0.57
MAPK8 P45983 1/20 0.57
RPS6KA3 P51812 1/20 0.57
TNK2 Q07912 1/20 0.57
MAP4K2 Q12851 1/20 0.57
PTK6 Q13882 1/20 0.57
RPS6KA2 Q15349 1/20 0.57
RPS6KA1 Q15418 1/20 0.57
RPS6KA6 Q9UK32 1/20 0.57
MET P08581 1/20 0.57

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
SCHEMBL2061099 0.94 ALK (0.76) ALKINSRKDRAURKBPTK2
SCHEMBL2060537 0.94 ALK (0.75) ALKINSRKDRAURKBPTK2
SCHEMBL2062271 0.93 ALK (0.77) ALKINSRKDRAURKBPTK2
SCHEMBL2061477 0.93 ALK (0.77) ALKINSRKDRAURKBPTK2
SCHEMBL2061892 0.93 ALK (0.77) ALKINSRKDRAURKBPTK2
SCHEMBL2060777 0.93 ALK (0.81) ALKINSRKDRAURKBPTK2
SCHEMBL2060985 0.92 ALK (0.74) ALKINSRKDRAURKBPTK2
SCHEMBL2061439 0.92 ALK (0.72) ALKINSRKDRAURKBPTK2
SCHEMBL2061844 0.91 ALK (0.75) ALKINSRKDRAURKBPTK2
SCHEMBL2060448 0.90 ALK (0.76) ALKINSRKDRAURKBPTK2

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 10 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2684874-B1 Fused bicyclic derivatives of 2,4-diaminopyrimidine as alk and C-met inhibitors CEPHALON INC (US) 2017-05-17 EP claimed
EP-2222647-B1 FUSED BICYCLIC DERIVATIVES OF 2,4-DIAMINOPYRIMIDINE AS ALK AND C-MET INHIBITORS CEPHALON INC (US) 2015-08-05 EP claimed
US-20090221555-A1 FUSED BICYCLIC DERIVATIVES OF 2,4-DIAMINOPYRIMIDINE AS ALK AND c-MET INHIBITORS CEPHALON, INC. (US) 2009-09-03 US claimed
EP-2684874-B1 Fused bicyclic derivatives of 2,4-diaminopyrimidine as alk and C-met inhibitors CEPHALON INC (US) 2017-05-17 EP disclosed
EP-2222647-B1 FUSED BICYCLIC DERIVATIVES OF 2,4-DIAMINOPYRIMIDINE AS ALK AND C-MET INHIBITORS CEPHALON INC (US) 2015-08-05 EP disclosed
EP-2684874-A1 Fused bicyclic derivatives of 2,4-diaminopyrimidine as alk and C-met inhibitors Cephalon, Inc. (US) 2014-01-15 EP disclosed
US-8552186-B2 Fused bicyclic derivatives of 2,4-diaminopyrimidine as ALK and c-MET inhibitors CEPHALON, INC. (US) 2013-10-08 US disclosed
US-20120165519-A1 Fused Bicyclic Derivatives of 2,4-Diaminopyrimidine as ALK and c-MET Inhibitors CEPHALON, INC. (US) 2012-06-28 US disclosed
US-8148391-B2 Fused bicyclic derivatives of 2,4-diaminopyrimidine as ALK and c-Met inhibitors CEPHALON, INC. (US) 2012-04-03 US disclosed
US-20090221555-A1 FUSED BICYCLIC DERIVATIVES OF 2,4-DIAMINOPYRIMIDINE AS ALK AND c-MET INHIBITORS CEPHALON, INC. (US) 2009-09-03 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 (2 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-20090221555-A1 FUSED BICYCLIC DERIVATIVES OF 2,4-DIAMINOPYRIMIDINE AS ALK AND c-MET INHIBITORS ALK, MET, RET ALK 1/4885INSR 241/4885KDR 22/4885
US-20120165519-A1 Fused Bicyclic Derivatives of 2,4-Diaminopyrimidine as ALK and c-MET Inhibitors ALK, MET, RET ALK 1/4885INSR 241/4885KDR 22/4885

“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.