SCHEMBL4750073

SCHEMBL4750073

COC(=O)Nc1nc2ccc(C(=O)Nc3cc(NC(=O)c4cccc(C(F)(F)F)c4)ccc3C)cc2s1

nearest known ligand 0.64

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
BRAF P15056 10/20 0.64
CSF1R P07333 5/20 0.58
KIT P10721 4/20 0.57
LCK P06239 2/20 0.53
SRC P12931 1/20 0.52
MAPK14 Q16539 1/20 0.52
KDR P35968 2/20 0.51
RAF1 P04049 1/20 0.51
PDGFRB P09619 1/20 0.51
PDGFRA P16234 1/20 0.51
ALDH1A1 P00352 2/20 0.51
TEK Q02763 1/20 0.50
HTT P42858 1/20 0.50
KDM4E B2RXH2 1/20 0.50
MEN1 O00255 1/20 0.50
MAPT P10636 1/20 0.50
HPGD P15428 1/20 0.50
KMT2A Q03164 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
SCHEMBL4746797 0.93 LCK (0.64) BRAFCSF1RKITLCK
SCHEMBL14042457 0.93 BRAF (0.61) BRAFCSF1RKITLCKSRC
SCHEMBL14042258 0.92 BRAF (0.58) BRAFCSF1RKITLCKSRC
SCHEMBL14042245 0.91 BRAF (0.57) BRAFCSF1RKITMAPK14RAF1
SCHEMBL14042250 0.91 BRAF (0.59) BRAFCSF1RKITLCKSRC
SCHEMBL14042725 0.91 BRAF (0.57) BRAFCSF1RKITLCKMEN1
SCHEMBL14042641 0.91 BRAF (0.57) BRAFCSF1RKITLCKSRC
SCHEMBL14042437 0.91 BRAF (0.67) BRAFCSF1RKITLCKSRC
SCHEMBL14042704 0.90 BRAF (0.64) BRAFCSF1RKITLCKSRC
SCHEMBL14042465 0.90 BRAF (0.57) BRAFCSF1RKITLCKSRC

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