SCHEMBL5801432

SCHEMBL5801432

Cc1ccc(NC(=O)c2cccc(CC(C)C#N)c2)cc1C(=O)Nc1ccc(NCCNC(=O)O)nc1

nearest known ligand 0.52

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
BRAF P15056 16/20 0.52
CYP2C9 P11712 3/20 0.52
KIT P10721 1/20 0.44
KDR P35968 1/20 0.44
MAPK14 Q16539 1/20 0.44
LCK P06239 1/20 0.44
BTK Q06187 1/20 0.44
ALDH1A1 P00352 1/20 0.43
MAPT P10636 1/20 0.43
CSF1R P07333 1/20 0.42

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
SCHEMBL4750077 0.83 BRAF (0.57) BRAFCYP2C9KDRMAPK14LCK
SCHEMBL3940366 0.82 BRAF (0.77) BRAFCYP2C9KITKDRMAPK14
SCHEMBL4970779 0.81 NR1H4 (0.49) BRAFCYP2C9
SCHEMBL4749868 0.80 BRAF (0.67) BRAFCYP2C9KDRMAPK14LCK
SCHEMBL4750556 0.79 BRAF (0.67) BRAFCYP2C9LCKBTKCSF1R
SCHEMBL5803018 0.78 BRAF (0.54) BRAFCYP2C9KITMAPK14LCK
SCHEMBL5802387 0.77 BRAF (0.45) BRAFCYP2C9LCKBTK
SCHEMBL4966996 0.74 ROCK2 (0.44) BRAFMAPK14ALDH1A1MAPT
SCHEMBL5799643 0.73 BRAF (0.49) BRAFCYP2C9MAPK14BTKCSF1R
SCHEMBL3932957 0.72 BRAF (0.76) BRAFCYP2C9KDRMAPK14LCK

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