SCHEMBL14070260

SCHEMBL14070260

Cc1ccc(NC(=O)c2cncc(F)c2)cc1Nc1nn(C)c2nc(NCCCCN(C)C)ncc12

nearest known ligand 0.47

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ BTK Q06187 4/20 0.47
▸ LCK P06239 3/20 0.42
▸ INSR P06213 2/20 0.41
▸ LYN P07948 2/20 0.41
▸ SRC P12931 2/20 0.41
▸ KDR P35968 2/20 0.41
▸ HCK P08631 1/20 0.41
▸ BRAF P15056 11/20 0.41
▸ MERTK Q12866 1/20 0.41
▸ MAPK14 Q16539 1/20 0.40

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
SCHEMBL14069575 0.94 BTK (0.48) BTKLCKINSRLYNSRC
SCHEMBL14070266 0.93 BTK (0.47) BTKLCKINSRLYNSRC
SCHEMBL14069748 0.88 BTK (0.47) BTKLCKINSRLYNSRC
SCHEMBL14070219 0.87 BTK (0.56) BTKLCKINSRLYNSRC
SCHEMBL14069747 0.87 BTK (0.45) BTKLCKINSRLYNSRC
SCHEMBL14069750 0.86 BTK (0.53) BTKLCKINSRLYNSRC
SCHEMBL14070283 0.85 BTK (0.45) BTKLCKINSRLYNSRC
SCHEMBL14070189 0.85 BTK (0.65) BTKLCKINSRLYNSRC
SCHEMBL14070292 0.85 BRAF (0.48) BTKLCKINSRLYNSRC
SCHEMBL14070270 0.85 KDM4E (0.46) BTKLCKINSRLYNSRC

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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