SCHEMBL3873074

SCHEMBL3873074

Cc1ccc(NC(=O)c2cccc(C(F)(F)F)c2)cc1-n1c(C)c2cnc(Nc3cccc(S(=O)(=O)N4CCOCC4)c3)nc2nc1=O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TNK2 Q07912 3/20 0.50
MAP4K2 Q12851 3/20 0.50
ABL1 P00519 2/20 0.50
KDM4E B2RXH2 1/20 0.48
USP2 O75604 1/20 0.48
CYP1A2 P05177 1/20 0.48
MAPT P10636 1/20 0.48
CYP2C9 P11712 1/20 0.48
PKM P14618 1/20 0.48
HPGD P15428 1/20 0.48
SMPD1 P17405 1/20 0.48
MAPK1 P28482 1/20 0.48
CYP2C19 P33261 1/20 0.48
JAK2 O60674 6/20 0.48
SRC P12931 5/20 0.48
JAK1 P23458 1/20 0.48
BCR P11274 1/20 0.47
BMX P51813 1/20 0.47
RIPK1 Q13546 1/20 0.47
RIPK3 Q9Y572 1/20 0.47

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
SCHEMBL3832093 0.86 SRC (0.54) TNK2MAP4K2ABL1JAK2SRC
SCHEMBL3829290 0.86 TNK2 (0.63) TNK2MAP4K2ABL1JAK2SRC
SCHEMBL3831604 0.86 BTK (0.53) TNK2MAP4K2ABL1JAK2SRC
SCHEMBL3831916 0.85 TNK2 (0.55) TNK2MAP4K2ABL1JAK2SRC
SCHEMBL3829420 0.85 LCK (0.55) TNK2MAP4K2ABL1JAK2SRC
SCHEMBL3827680 0.85 BTK (0.62) TNK2MAP4K2ABL1JAK2SRC
SCHEMBL3825562 0.85 TNK2 (0.55) TNK2MAP4K2ABL1JAK2SRC
SCHEMBL3832162 0.84 TNK2 (0.54) TNK2MAP4K2ABL1JAK2SRC
SCHEMBL3830962 0.84 CSF1R (0.57) TNK2MAP4K2ABL1MAPTJAK2
SCHEMBL3831040 0.84 JAK2 (0.53) TNK2MAP4K2ABL1JAK2SRC

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-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