SCHEMBL27720109

SCHEMBL27720109

CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(OCCN4CCN(C)CC4)c(Cl)c3)cc2)ccc1F

nearest known ligand 0.52

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 2/20 0.52
HTR2A P28223 5/20 0.51
HTR2C P28335 4/20 0.51
MCHR1 Q99705 1/20 0.50
MET P08581 4/20 0.49
SRC P12931 1/20 0.48
HTR1A P08908 1/20 0.48
DRD2 P14416 1/20 0.48
EGFR P00533 3/20 0.46
KDR P35968 1/20 0.46
EPHX2 P34913 3/20 0.45
HRH3 Q9Y5N1 1/20 0.45

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
SCHEMBL27720161 0.96 HTR2A (0.51) MAPK14HTR2AHTR2CMCHR1MET
SCHEMBL27741147 0.92 EPHX2 (0.56) MAPK14HTR2AHTR2CMETKDR
SCHEMBL27740985 0.88 EPHX2 (0.62) MAPK14HTR2AHTR2CEGFRKDR
SCHEMBL27740980 0.84 MAPK14 (0.56) MAPK14METSRCKDREPHX2
SCHEMBL27720139 0.84 ALDH1A1 (0.52) MAPK14HTR2AHTR2CMETSRC
SCHEMBL27740978 0.80 PNLIP (0.51) MAPK14HTR2AHTR2CMETSRC
SCHEMBL27720113 0.80 BRAF (0.48) MAPK14HTR2AHTR2CMETSRC
SCHEMBL27720157 0.80 MAPT (0.64) MAPK14HTR2AHTR2CMETSRC
SCHEMBL27740975 0.79 RAB9A (0.50) MAPK14METSRCKDREPHX2
SCHEMBL27720100 0.77 BRAF (0.63) MAPK14HTR2AHTR2CMETSRC

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