SCHEMBL14070163

SCHEMBL14070163

Cc1ccc(NC(=O)c2cccc(C(F)(F)F)c2)cc1Nc1nn(C)c2nc(NCCN3CCN(C)CC3)ncc12

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BTK Q06187 4/20 0.67
LCK P06239 10/20 0.58
KDR P35968 7/20 0.58
SRC P12931 7/20 0.58
LYN P07948 5/20 0.58
INSR P06213 4/20 0.58
HCK P08631 4/20 0.58
MAPK14 Q16539 4/20 0.57
BRAF P15056 5/20 0.57
MAPK9 P45984 2/20 0.52
ABL1 P00519 1/20 0.52
FYN P06241 1/20 0.52
CSF1R P07333 1/20 0.52
TEK Q02763 1/20 0.52
TNK2 Q07912 1/20 0.51
MAP4K2 Q12851 1/20 0.51
TYK2 P29597 1/20 0.51
SYK P43405 1/20 0.51
MAPK8 P45983 1/20 0.51
JAK3 P52333 1/20 0.51

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
SCHEMBL14070187 0.96 BTK (0.66) BTKLCKKDRSRCLYN
SCHEMBL14069862 0.94 BTK (0.60) BTKLCKKDRSRCLYN
SCHEMBL14070167 0.93 LCK (0.68) BTKLCKKDRSRCLYN
SCHEMBL14069856 0.91 LCK (0.66) BTKLCKKDRSRCLYN
SCHEMBL14070195 0.89 BTK (0.69) BTKLCKKDRSRCLYN
SCHEMBL14070183 0.89 LCK (0.68) BTKLCKKDRSRCLYN
SCHEMBL14070186 0.89 BTK (0.68) BTKLCKKDRSRCLYN
SCHEMBL14069836 0.88 BTK (0.67) BTKLCKKDRSRCLYN
SCHEMBL14070253 0.88 LCK (0.69) BTKLCKKDRSRCLYN
SCHEMBL14070184 0.88 BTK (0.66) BTKLCKKDRSRCLYN

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