SCHEMBL14070189

SCHEMBL14070189

Cc1ccc(NC(=O)c2cccc(C(F)(F)F)c2)cc1Nc1nn(C)c2nc(NCCCCN(C)C)ncc12

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BTK Q06187 5/20 0.65
LCK P06239 7/20 0.57
SRC P12931 5/20 0.57
INSR P06213 4/20 0.57
LYN P07948 4/20 0.57
HCK P08631 4/20 0.57
KDR P35968 4/20 0.57
BRAF P15056 6/20 0.49
MAPK14 Q16539 3/20 0.49
TNK2 Q07912 2/20 0.49
MAP4K2 Q12851 2/20 0.49
ABL1 P00519 2/20 0.49
SYK P43405 2/20 0.49
DDR1 Q08345 2/20 0.49
DDR2 Q16832 2/20 0.49
ESYT2 A0FGR8 1/20 0.49
PLEKHG3 A1L390 1/20 0.49
NBAS A2RRP1 1/20 0.49
CNOT1 A5YKK6 1/20 0.49
TBKBP1 A7MCY6 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
SCHEMBL14069836 0.95 BTK (0.67) BTKLCKSRCINSRLYN
SCHEMBL14069863 0.94 BTK (0.58) BTKLCKSRCINSRLYN
SCHEMBL14070219 0.94 BTK (0.56) BTKLCKSRCINSRLYN
SCHEMBL14069857 0.92 BTK (0.58) BTKLCKSRCINSRLYN
SCHEMBL14070184 0.92 BTK (0.66) BTKLCKSRCINSRLYN
SCHEMBL14070065 0.91 BRAF (0.60) BTKLCKSRCINSRLYN
SCHEMBL14069750 0.90 BTK (0.53) BTKLCKSRCINSRLYN
SCHEMBL14069749 0.90 BTK (0.53) BTKLCKSRCINSRLYN
SCHEMBL14070282 0.90 BTK (0.60) BTKLCKSRCINSRLYN
SCHEMBL14070195 0.89 BTK (0.69) BTKLCKSRCINSRLYN

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2008112695-A2 PYRAZOLO [3,4-D] PYRIMIDINES AND 1, 2, 5, 6-TETRAAZA- AS- INDACENES AS PROTEIN KINASE INHIBITORS FOR CANCER TREATMENT IRM LLC (BM) 2008-09-18 WO disclosed