SCHEMBL5310973

SCHEMBL5310973

COCN(C(=O)N(Cc1ccccc1)C(=O)c1c(F)cccc1F)c1ccc(SC(F)(F)F)cc1F

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.41
RAB9A P51151 2/20 0.37
GAA P10253 1/20 0.36
HPGD P15428 1/20 0.36
KMT2A Q03164 4/20 0.33
MEN1 O00255 3/20 0.33
HDAC4 P56524 2/20 0.33
HDAC6 Q9UBN7 2/20 0.33
CETP P11597 2/20 0.33
HDAC3 O15379 1/20 0.32
HDAC1 Q13547 1/20 0.32
NPC1 O15118 1/20 0.32
LMNA P02545 1/20 0.32
MAPT P10636 1/20 0.32
TSHR P16473 1/20 0.32
MAPK1 P28482 1/20 0.32
HTT P42858 1/20 0.32
UBE2M P61081 1/20 0.32
DCUN1D1 Q96GG9 1/20 0.32
FFAR4 Q5NUL3 1/20 0.32

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
SCHEMBL14494224 0.90 LMNA (0.33) TDP1LMNAMAPTTSHRMAPK1
SCHEMBL5314255 0.87 TP53 (0.31)
SCHEMBL5314123 0.86
SCHEMBL5316877 0.86 KMT2A (0.35) TDP1RAB9AKMT2AMEN1NPC1
SCHEMBL5313933 0.85 TDP1 (0.31) TDP1LMNAMAPTTSHRMAPK1
SCHEMBL4159030 0.85 TDP1 (0.45) TDP1RAB9AGAAHPGDKMT2A
SCHEMBL5313283 0.85
SCHEMBL14493983 0.84
SCHEMBL5314149 0.84 CYP3A4 (0.30)
SCHEMBL14494200 0.84 GPBAR1 (0.34)

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