SCHEMBL5799643

SCHEMBL5799643

Cc1ncc(NC(=O)c2cc(NC(=O)c3cccc(CC(C)C#N)c3)ccc2Cl)cc1N

nearest known ligand 0.49

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
BRAF P15056 7/20 0.49
CSF1R P07333 13/20 0.49
CYP2C9 P11712 4/20 0.49
JAK2 O60674 1/20 0.49
PDGFRB P09619 1/20 0.49
FGFR1 P11362 1/20 0.49
EPHB4 P54760 1/20 0.49
PTK2 Q05397 1/20 0.49
MAPK14 Q16539 1/20 0.49
BTK Q06187 1/20 0.43

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
SCHEMBL4749868 0.85 BRAF (0.67) BRAFCSF1RCYP2C9JAK2PDGFRB
SCHEMBL4750077 0.84 BRAF (0.57) BRAFCYP2C9MAPK14BTK
SCHEMBL3934465 0.80 BRAF (0.75) BRAFCSF1RCYP2C9JAK2PDGFRB
SCHEMBL5800552 0.80 MEN1 (0.53) CSF1RCYP2C9
SCHEMBL4966996 0.80 ROCK2 (0.44) BRAFMAPK14
SCHEMBL3936637 0.76 BRAF (0.51) BRAFCSF1RCYP2C9JAK2PDGFRB
SCHEMBL4750556 0.76 BRAF (0.67) BRAFCSF1RCYP2C9BTK
SCHEMBL4970779 0.75 NR1H4 (0.49) BRAFCYP2C9
SCHEMBL5803018 0.75 BRAF (0.54) BRAFCSF1RCYP2C9MAPK14
SCHEMBL4749967 0.74 BRAF (0.57) BRAFCSF1RCYP2C9JAK2PDGFRB

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-2006067445-A2 CSF-1R KINASE INHIBITORS ASTRAZENECA AB (SE) 2006-06-29 WO disclosed