SCHEMBL2060756

SCHEMBL2060756

CNCc1ccccc1Nc1nc(Cl)ncc1Cl

nearest known ligand 0.43

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
LRRK2 Q5S007 5/20 0.43
ALK Q9UM73 2/20 0.43
INSR P06213 1/20 0.43
ULK1 O75385 1/20 0.42
CCNA2 P20248 4/20 0.41
CDK2 P24941 4/20 0.41
CCNK O75909 3/20 0.41
CCND3 P30281 3/20 0.41
CDK9 P50750 3/20 0.41
CDK6 Q00534 3/20 0.41
JAK2 O60674 1/20 0.40
SLC6A2 P23975 2/20 0.39
SLC6A4 P31645 2/20 0.39
SLC6A3 Q01959 2/20 0.39
MAPK8 P45983 1/20 0.39
KMT2A Q03164 1/20 0.39
BCL6 P41182 1/20 0.38
PDE2A O00408 1/20 0.38
MAPK1 P28482 1/20 0.38

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
SCHEMBL25278838 0.83 ULK1 (0.45) LRRK2ULK1CDK2CDK9JAK2
SCHEMBL2062120 0.83 ULK1 (0.43) ALKULK1CCNA2CDK2CCNK
SCHEMBL2061884 0.83 BPTF (0.44) LRRK2ALKINSRULK1CCNA2
SCHEMBL30833627 0.83 BCL6 (0.39) LRRK2ALKULK1CCNA2CDK2
SCHEMBL18812831 0.82 CCNA2 (0.41) LRRK2ALKULK1CCNA2CDK2
SCHEMBL26906809 0.80 ALK (0.48) ALKINSRULK1CCNA2CDK2
SCHEMBL2062486 0.80 MAPK9 (0.38) LRRK2ALKINSRULK1CCNA2
SCHEMBL29904714 0.80 ALK (0.48) ALKINSRULK1CCNA2CDK2
SCHEMBL2916138 0.80 ALK (0.39) LRRK2ALKULK1CCNA2CDK2
SCHEMBL2062564 0.79 IGF1R (0.54) LRRK2ALKULK1CCNA2CDK2

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 9 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 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
EP-2222647-A1 FUSED BICYCLIC DERIVATIVES OF 2,4-DIAMINOPYRIMIDINE AS ALK AND C-MET INHIBITORS Cephalon, Inc. (US) 2010-09-01 EP 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
WO-2008051547-A1 FUSED BICYCLIC DERIVATIVES OF 2,4-DIAMINOPYRIMIDINE AS ALK AND C-MET INHIBITORS CEPHALON, INC. (US) 2008-05-02 WO 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 LRRK2 885/4885ALK 1/4885INSR 241/4885
US-20120165519-A1 Fused Bicyclic Derivatives of 2,4-Diaminopyrimidine as ALK and c-MET Inhibitors ALK, MET, RET LRRK2 885/4885ALK 1/4885INSR 241/4885

“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.