SCHEMBL4862030

SCHEMBL4862030

Cc1ccc(NC(=O)c2cccc(C(F)(F)F)c2)cc1NC(=O)c1ccc2nc(NC(=O)NC(C)(C)C)sc2c1

nearest known ligand 0.64

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
LCK P06239 6/20 0.64
BRAF P15056 10/20 0.62
SRC P12931 2/20 0.59
FYN P06241 1/20 0.59
CSF1R P07333 4/20 0.56
KIT P10721 3/20 0.56
MAPK14 Q16539 1/20 0.51
MEN1 O00255 1/20 0.50
LMNA P02545 1/20 0.50
POLB P06746 1/20 0.50
MAPT P10636 1/20 0.50
KMT2A Q03164 1/20 0.50
NPSR1 Q6W5P4 1/20 0.50
RAF1 P04049 1/20 0.50
PDGFRB P09619 1/20 0.50
PDGFRA P16234 1/20 0.50
KDR P35968 1/20 0.50

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
SCHEMBL14042471 0.94 LCK (0.65) LCKBRAFSRCFYNCSF1R
SCHEMBL14042704 0.92 BRAF (0.64) LCKBRAFSRCCSF1RKIT
SCHEMBL14042259 0.90 BRAF (0.62) LCKBRAFSRCCSF1RKIT
SCHEMBL14042708 0.89 BRAF (0.61) LCKBRAFSRCCSF1RKIT
SCHEMBL14042707 0.89 BRAF (0.61) LCKBRAFSRCCSF1RKIT
SCHEMBL14042437 0.89 BRAF (0.67) LCKBRAFSRCCSF1RKIT
SCHEMBL4750073 0.88 BRAF (0.64) LCKBRAFSRCCSF1RKIT
SCHEMBL4746797 0.88 LCK (0.64) LCKBRAFCSF1RKIT
SCHEMBL14042642 0.88 BRAF (0.63) LCKBRAFSRCCSF1RKIT
SCHEMBL14042661 0.87 BRAF (0.65) LCKBRAFSRCCSF1RKIT

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-2008124393-A1 BENZOTHIAZOLE DERIVATIVES AND THEIR USE AS PROTEIN KINASE INHIBITORS IRM LLC (BM) 2008-10-16 WO disclosed
WO-2008124393-A1 BENZOTHIAZOLE DERIVATIVES AND THEIR USE AS PROTEIN KINASE INHIBITORS IRM LLC (BM) 2008-10-16 WO disclosed