SCHEMBL4789210

SCHEMBL4789210

CCN1CCN(c2cc(C(=O)Nc3ccc(C)c(NC(=O)c4cnc5[nH]ccc5c4)c3)cc(C(F)(F)F)c2)CC1

nearest known ligand 0.59

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
BRAF P15056 9/20 0.59
EGFR P00533 2/20 0.59
CSF1R P07333 6/20 0.56
RAF1 P04049 6/20 0.56
LYN P07948 2/20 0.56
ABL1 P00519 2/20 0.56
INSR P06213 1/20 0.56
LCK P06239 1/20 0.56
HCK P08631 1/20 0.56
SRC P12931 1/20 0.56
KDR P35968 1/20 0.56
CHRM4 P08173 1/20 0.52
CHRM1 P11229 1/20 0.52
MAPK14 Q16539 1/20 0.51

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
SCHEMBL4789368 0.93 BRAF (0.60) BRAFEGFRCSF1RRAF1LYN
SCHEMBL4789207 0.92 ABL1 (0.55) BRAFEGFRCSF1RRAF1LYN
SCHEMBL4788129 0.92 BRAF (0.67) BRAFEGFRCSF1RRAF1LYN
SCHEMBL4789587 0.89 CSF1R (0.68) BRAFEGFRCSF1RRAF1LYN
SCHEMBL4788677 0.86 CSF1R (0.56) BRAFCSF1RRAF1LYNINSR
SCHEMBL4789367 0.85 ABL1 (0.56) BRAFEGFRCSF1RRAF1LYN
SCHEMBL4788124 0.83 ABL1 (0.59) BRAFEGFRCSF1RRAF1LYN
SCHEMBL4788638 0.83 CSF1R (0.69) BRAFEGFRCSF1RRAF1LYN
SCHEMBL4789584 0.81 CSF1R (0.57) BRAFEGFRCSF1RRAF1LYN
SCHEMBL3387002 0.81 LYN (0.55) BRAFCSF1RRAF1LYNINSR

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 3 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
WO-2008144253-A1 PROTEIN KINASE INHIBITORS AND METHODS FOR USING THEREOF IRM LLC (BM) 2008-11-27 WO disclosed