SCHEMBL14070080

SCHEMBL14070080

CCN1CCN(c2cc(C(=O)Nc3ccc(C)c(Nc4nn(C)c5nc(NCCCCN(C)C)ncc45)c3)cc(C(F)(F)F)c2)CC1

nearest known ligand 0.56

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ BRAF P15056 15/20 0.56
▸ BTK Q06187 2/20 0.51
▸ LYN P07948 3/20 0.50
▸ INSR P06213 2/20 0.50
▸ LCK P06239 2/20 0.50
▸ HCK P08631 2/20 0.50
▸ SRC P12931 2/20 0.50
▸ KDR P35968 2/20 0.50
▸ RAF1 P04049 4/20 0.48
▸ CSF1R P07333 2/20 0.45

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
SCHEMBL14070214 0.95 BRAF (0.56) BRAFBTKLYNINSRLCK
SCHEMBL14070219 0.90 BTK (0.56) BRAFBTKLYNINSRLCK
SCHEMBL14069576 0.87 CSF1R (0.51) BRAFBTKLYNINSRLCK
SCHEMBL14070189 0.86 BTK (0.65) BRAFBTKLYNINSRLCK
SCHEMBL14069584 0.86 LYN (0.59) BRAFBTKLYNINSRLCK
SCHEMBL14070218 0.83 CSF1R (0.53) BRAFBTKLYNINSRLCK
SCHEMBL14069750 0.83 BTK (0.53) BRAFBTKLYNINSRLCK
SCHEMBL14069575 0.83 BTK (0.48) BRAFBTKLYNINSRLCK
SCHEMBL14069863 0.82 BTK (0.58) BRAFBTKLYNINSRLCK
SCHEMBL14069748 0.81 BTK (0.47) BRAFBTKLYNINSRLCK

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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