SCHEMBL5312744

SCHEMBL5312744

CN(C(=O)c1c(F)cccc1F)C(=O)N(CCO)c1ccc(SC(F)(F)F)cc1F

nearest known ligand 0.34

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ABL1 P00519 6/20 0.34
TDP1 Q9NUW8 2/20 0.33
MAPT P10636 2/20 0.32
HTT P42858 2/20 0.32
KDM4E B2RXH2 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
LMNA P02545 1/20 0.32
TSHR P16473 1/20 0.32
MAPK1 P28482 1/20 0.32
POLB P06746 1/20 0.31
RORC P51449 5/20 0.31
GPBAR1 Q8TDU6 1/20 0.31
NPC1 O15118 1/20 0.30
RAB9A P51151 1/20 0.30
RORA P35398 1/20 0.30
RORB Q92753 1/20 0.30

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
SCHEMBL4145428 0.91 RORC (0.36) TDP1MAPTHTTKDM4ENPSR1
SCHEMBL5310976 0.91 MAPT (0.34) TDP1MAPTHTTKDM4ENPSR1
SCHEMBL5311759 0.90 RORC (0.32) TDP1MAPTHTTKDM4ENPSR1
SCHEMBL5314885 0.89 KDM4E (0.32) TDP1MAPTHTTKDM4ENPSR1
SCHEMBL5313933 0.89 TDP1 (0.31) TDP1MAPTHTTKDM4ENPSR1
SCHEMBL5316882 0.87 GPBAR1 (0.34) TDP1MAPTHTTLMNATSHR
SCHEMBL4154435 0.86 RORC (0.36) TDP1MAPTHTTLMNATSHR
SCHEMBL14494345 0.86
SCHEMBL5311816 0.86
SCHEMBL5311405 0.84 RORA (0.30) RORCRORARORB

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2007066496-A1 BENZOYLUREA COMPOUND AND USE THEREOF SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2007-06-14 WO disclosed