SCHEMBL14069862

SCHEMBL14069862

Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1Nc1nn(C)c2nc(NCCN3CCN(C)CC3)ncc12

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ BTK Q06187 5/20 0.60
▸ LCK P06239 12/20 0.60
▸ KDR P35968 8/20 0.60
▸ SRC P12931 6/20 0.60
▸ INSR P06213 5/20 0.60
▸ LYN P07948 5/20 0.60
▸ HCK P08631 5/20 0.60
▸ BRAF P15056 6/20 0.57
▸ MAPK14 Q16539 4/20 0.56
▸ TYK2 P29597 2/20 0.56
▸ SYK P43405 2/20 0.56
▸ MAPK8 P45983 2/20 0.56
▸ MAPK9 P45984 2/20 0.56
▸ MAPK10 P53779 2/20 0.56
▸ JAK3 P52333 2/20 0.56
▸ ESYT2 A0FGR8 1/20 0.56
▸ PLEKHG3 A1L390 1/20 0.56
▸ NBAS A2RRP1 1/20 0.56
▸ CNOT1 A5YKK6 1/20 0.56
▸ TBKBP1 A7MCY6 1/20 0.56

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
SCHEMBL14069856 0.96 LCK (0.66) BTKLCKKDRSRCINSR
SCHEMBL14070163 0.94 BTK (0.67) BTKLCKKDRSRCINSR
SCHEMBL14070253 0.93 LCK (0.69) BTKLCKKDRSRCINSR
SCHEMBL14070187 0.91 BTK (0.66) BTKLCKKDRSRCINSR
SCHEMBL14070271 0.89 BTK (0.61) BTKLCKKDRSRCINSR
SCHEMBL14070209 0.89 LCK (0.64) BTKLCKKDRSRCINSR
SCHEMBL14070277 0.89 BTK (0.60) BTKLCKKDRSRCINSR
SCHEMBL14070282 0.88 BTK (0.60) BTKLCKKDRSRCINSR
SCHEMBL14070248 0.88 BTK (0.60) BTKLCKKDRSRCINSR
SCHEMBL14070167 0.88 LCK (0.68) BTKLCKKDRSRCINSR

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
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