SCHEMBL4788095

SCHEMBL4788095

CNc1c(C(=O)Nc2cc(NC(=O)c3ccc(Cl)c(C(F)(F)F)c3)ccc2C)cnc2[nH]ccc12

nearest known ligand 0.63

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
BRAF P15056 15/20 0.63
RAF1 P04049 5/20 0.59
ARAF P10398 4/20 0.59
KDR P35968 3/20 0.50
BTK Q06187 2/20 0.49
LCK P06239 2/20 0.48
JAK3 P52333 1/20 0.48
MAPK14 Q16539 1/20 0.48
DDR1 Q08345 2/20 0.47
CSF1R P07333 1/20 0.47
RET P07949 1/20 0.47
PDGFRB P09619 1/20 0.47
FGFR2 P21802 1/20 0.47
EPHA2 P29317 1/20 0.47
DDR2 Q16832 1/20 0.47

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
SCHEMBL4788857 0.91 BRAF (0.52) BRAFRAF1ARAFKDRLCK
SCHEMBL4788092 0.91 BRAF (0.53) BRAFRAF1ARAFKDRBTK
SCHEMBL4788891 0.85 CSF1R (0.61) BRAFRAF1KDRBTKLCK
SCHEMBL4788647 0.84 LCK (0.46) BRAFRAF1ARAFKDRLCK
SCHEMBL4789710 0.84 BRAF (0.52) BRAFBTKMAPK14DDR1CSF1R
SCHEMBL4788872 0.83 DDR1 (0.70) BRAFRAF1BTKMAPK14DDR1
SCHEMBL4789921 0.83 KDR (0.48) BRAFRAF1KDRLCKMAPK14
SCHEMBL4789714 0.82 BRAF (0.48) BRAFRAF1KDRMAPK14DDR1
SCHEMBL4788852 0.82 BRAF (0.43) BRAFRAF1ARAFKDRLCK
SCHEMBL4788672 0.81 LMNA (0.50) BRAFRAF1KDRMAPK14DDR1

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