SCHEMBL4789710

SCHEMBL4789710

CNc1c(C(=O)Nc2cc(NC(=O)c3cccc(Cl)c3)ccc2C)cnc2[nH]ccc12

nearest known ligand 0.52

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
BRAF P15056 8/20 0.52
CSF1R P07333 3/20 0.50
BTK Q06187 1/20 0.47
ABL1 P00519 1/20 0.45
SRC P12931 1/20 0.45
DDR1 Q08345 1/20 0.45
MAPK14 Q16539 1/20 0.45
DDR2 Q16832 1/20 0.45
KCNQ3 O43525 2/20 0.44
KCNQ2 O43526 2/20 0.44
KCNE1 P15382 2/20 0.44
KCNQ1 P51787 2/20 0.44
BMX P51813 3/20 0.44
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
KIT P10721 1/20 0.44
KCNQ5 Q9NR82 1/20 0.43
RXFP1 Q9HBX9 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
SCHEMBL4789714 0.91 BRAF (0.48) BRAFCSF1RABL1SRCDDR1
SCHEMBL4789788 0.90 BMX (0.46) BRAFCSF1RABL1SRCDDR1
SCHEMBL4789707 0.89 BRAF (0.47) BRAFBTKABL1MEN1KMT2A
SCHEMBL4789715 0.88 BMX (0.58) BRAFBTKMAPK14KCNQ3KCNQ2
SCHEMBL4788891 0.87 CSF1R (0.61) BRAFCSF1RBTKABL1SRC
SCHEMBL4788095 0.84 BRAF (0.63) BRAFCSF1RBTKDDR1MAPK14
SCHEMBL4788857 0.83 BRAF (0.52) BRAFABL1SRCDDR1MAPK14
SCHEMBL4788672 0.83 LMNA (0.50) BRAFCSF1RABL1SRCDDR1
SCHEMBL4789713 0.82 BMX (0.41) BRAFCSF1RABL1SRCDDR1
SCHEMBL4788647 0.81 LCK (0.46) BRAFCSF1RABL1SRCDDR1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2008144253-A1 PROTEIN KINASE INHIBITORS AND METHODS FOR USING THEREOF IRM LLC (BM) 2008-11-27 WO claimed
WO-2008144253-A1 PROTEIN KINASE INHIBITORS AND METHODS FOR USING THEREOF IRM LLC (BM) 2008-11-27 WO disclosed