SCHEMBL3830962

SCHEMBL3830962

Cc1ccc(NC(=O)c2cccc(C(F)(F)F)c2)cc1-n1c(C)c2cnc(Nc3cccnc3)nc2nc1=O

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CSF1R P07333 4/20 0.57
BRAF P15056 2/20 0.57
ABL1 P00519 4/20 0.56
TNK2 Q07912 3/20 0.56
MAP4K2 Q12851 3/20 0.56
BCR P11274 2/20 0.56
BMX P51813 1/20 0.56
RIPK1 Q13546 1/20 0.56
RIPK3 Q9Y572 1/20 0.56
JAK2 O60674 4/20 0.55
SRC P12931 4/20 0.55
LCK P06239 4/20 0.53
BTK Q06187 4/20 0.53
TEK Q02763 1/20 0.52
SYK P43405 1/20 0.52
KIT P10721 1/20 0.51
KDR P35968 1/20 0.51
MAPK14 Q16539 1/20 0.51
JAK1 P23458 1/20 0.49
LMNA P02545 1/20 0.49

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
SCHEMBL3827877 0.93 TNK2 (0.56) CSF1RBRAFABL1TNK2MAP4K2
SCHEMBL3824774 0.93 SRC (0.63) CSF1RBRAFABL1TNK2MAP4K2
SCHEMBL3829290 0.93 TNK2 (0.63) ABL1TNK2MAP4K2BCRBMX
SCHEMBL3831814 0.92 TNK2 (0.56) ABL1TNK2MAP4K2BCRBMX
SCHEMBL3825109 0.92 TNK2 (0.54) ABL1TNK2MAP4K2BCRBMX
SCHEMBL3825060 0.91 TNK2 (0.52) CSF1RBRAFABL1TNK2MAP4K2
SCHEMBL3825269 0.91 ABL1 (0.52) CSF1RBRAFABL1TNK2MAP4K2
SCHEMBL3830308 0.91 TNK2 (0.52) CSF1RBRAFABL1TNK2MAP4K2
SCHEMBL3831916 0.91 TNK2 (0.55) ABL1TNK2MAP4K2BCRBMX
SCHEMBL3827885 0.91 TNK2 (0.55) ABL1TNK2MAP4K2BCRBMX

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1651648-A4 COMPOUNDS AND COMPOSITIONS AS PROTEIN KINASE INHIBITORS IRM LLC (BM) 2009-09-02 EP claimed
JP-2007500725-A 2007-01-18 JP claimed
EP-1651648-A2 COMPOUNDS AND COMPOSITIONS AS PROTEIN KINASE INHIBITORS IRM LLC (BM) 2006-05-03 EP claimed
WO-2005011597-A2 COMPOUNDS AND COMPOSITIONS AS PROTEIN KINASE INHIBITORS IRM LLC (BM) 2005-02-10 WO claimed
EP-1651648-A4 COMPOUNDS AND COMPOSITIONS AS PROTEIN KINASE INHIBITORS IRM LLC (BM) 2009-09-02 EP disclosed
EP-1651648-A2 COMPOUNDS AND COMPOSITIONS AS PROTEIN KINASE INHIBITORS IRM LLC (BM) 2006-05-03 EP disclosed
WO-2005011597-A2 COMPOUNDS AND COMPOSITIONS AS PROTEIN KINASE INHIBITORS IRM LLC (BM) 2005-02-10 WO disclosed