SCHEMBL27720106

SCHEMBL27720106

CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(CCl)c3)cc2)ccc1F

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAF1 P04049 9/20 0.51
BRAF P15056 8/20 0.49
ARAF P10398 3/20 0.49
EPHX2 P34913 3/20 0.49
MEN1 O00255 3/20 0.49
KMT2A Q03164 3/20 0.49
RIPK2 O43353 2/20 0.49
ABCB11 O95342 2/20 0.49
ABL1 P00519 2/20 0.49
RET P07949 2/20 0.49
HTR1A P08908 2/20 0.49
PDGFRB P09619 2/20 0.49
ADORA3 P0DMS8 2/20 0.49
KIT P10721 2/20 0.49
FGFR1 P11362 2/20 0.49
PDGFRA P16234 2/20 0.49
FLT1 P17948 2/20 0.49
MAOA P21397 2/20 0.49
EPHA1 P21709 2/20 0.49
TBXA2R P21731 2/20 0.49

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
SCHEMBL27720157 0.87 MAPT (0.64) RAF1BRAFARAFEPHX2MEN1
SCHEMBL27720100 0.86 BRAF (0.63) RAF1BRAFARAFEPHX2MEN1
SCHEMBL27720112 0.85 EPHX2 (0.50) RAF1BRAFARAFEPHX2MEN1
SCHEMBL27740980 0.84 MAPK14 (0.56) RAF1EPHX2ABL1KDRMAPK14
SCHEMBL27740982 0.84 KDR (0.53) RAF1BRAFEPHX2KDRMAPK14
SCHEMBL27720191 0.83 CDK8 (0.55) RAF1BRAFMEN1KMT2AABL1
SCHEMBL27720155 0.82 BRAF (0.64) RAF1BRAFARAFEPHX2ABL1
SCHEMBL27720117 0.81 BRAF (0.61) RAF1BRAFARAFEPHX2MEN1
SCHEMBL27720129 0.81 MEN1 (0.66) RAF1BRAFARAFEPHX2MEN1
SCHEMBL27740983 0.80 CDK8 (0.56) RAF1BRAFMEN1KMT2AABL1

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
CN-101298427-B Diaryl urea compound and use thereof GUANGZHOU INST BIOMED & HEALTH 2012-03-21 CN disclosed
CN-101298427-A Diaryl urea compound and use thereof GUANGZHOU INST BIOMED & HEALTH (CN) 2008-11-05 CN disclosed