SCHEMBL27740975

SCHEMBL27740975

CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(N4CCN(C)CC4)cc3)cc2)ccc1F

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 7/20 0.50
NPC1 O15118 6/20 0.50
MAPK14 Q16539 1/20 0.50
FGFR1 P11362 1/20 0.49
FGFR2 P21802 1/20 0.49
FGFR3 P22607 1/20 0.49
KDR P35968 1/20 0.49
SIRT6 Q8N6T7 1/20 0.49
KMT2A Q03164 2/20 0.48
MAPT P10636 2/20 0.48
TSHR P16473 2/20 0.48
TP53 P04637 1/20 0.48
MAPK1 P28482 1/20 0.48
MEN1 O00255 1/20 0.47
ABL1 P00519 1/20 0.47
MET P08581 1/20 0.47
MST1R Q04912 1/20 0.47
S1PR2 O95136 1/20 0.46
SRC P12931 1/20 0.46
HPGD P15428 1/20 0.46

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
SCHEMBL27720111 0.90 KDR (0.49) RAB9ANPC1MAPK14FGFR1FGFR2
SCHEMBL27720139 0.88 ALDH1A1 (0.52) RAB9ANPC1MAPK14FGFR1FGFR2
SCHEMBL27720155 0.82 BRAF (0.64) RAB9ANPC1MAPK14KDRMAPT
SCHEMBL27720117 0.81 BRAF (0.61) RAB9ANPC1KMT2AMAPTTSHR
SCHEMBL27720100 0.81 BRAF (0.63) RAB9ANPC1MAPK14FGFR1FGFR2
SCHEMBL27740980 0.81 MAPK14 (0.56) MAPK14KDRABL1METSRC
SCHEMBL27720255 0.79 RAB9A (0.58) RAB9ANPC1KMT2AMAPTTSHR
SCHEMBL27720157 0.78 MAPT (0.64) RAB9ANPC1MAPK14FGFR1FGFR2
SCHEMBL27720178 0.78 RAB9A (0.60) RAB9ANPC1KDRKMT2AMAPT
SCHEMBL27740983 0.78 CDK8 (0.56) RAB9ANPC1MAPK14KDRKMT2A

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