SCHEMBL4636452

SCHEMBL4636452

C=CCN(C(=O)c1cccc(F)c1F)C(=O)N(C)c1ccc(SC(F)(F)F)cc1F

nearest known ligand 0.31

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CES2 O00748 1/20 0.31
BCHE P06276 1/20 0.31
CES1 P23141 1/20 0.31
LMNA P02545 1/20 0.31
MAPT P10636 1/20 0.31
TSHR P16473 1/20 0.31
MAPK1 P28482 1/20 0.31
HTT P42858 1/20 0.31
GPBAR1 Q8TDU6 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
SCHEMBL4145562 0.90 RORC (0.33) LMNAMAPTTSHRMAPK1HTT
SCHEMBL4636222 0.85 CES2 (0.35) CES2BCHECES1LMNAMAPT
SCHEMBL4636993 0.85 CES2 (0.31) CES2BCHECES1LMNAMAPT
SCHEMBL4636946 0.84 RXFP1 (0.34) CES2BCHECES1LMNAMAPT
SCHEMBL4636459 0.81 LMNA (0.37) LMNAMAPTTSHRHTT
SCHEMBL4636385 0.81
SCHEMBL4636985 0.80 RXFP1 (0.39) MAPTGPBAR1
SCHEMBL4157996 0.79 RORC (0.35) LMNAMAPTTSHRMAPK1HTT
SCHEMBL4142662 0.78 RORC (0.34) LMNAMAPTTSHRMAPK1HTT
SCHEMBL4637560 0.77 PPARG (0.34) LMNAMAPTTSHRMAPK1HTT

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
EP-1937629-A2 BENZOYLUREA COMPOUNDS AND USE THEREOF Sumitomo Chemical Company, Limited (JP) 2008-07-02 EP disclosed
WO-2007046513-A2 BENZOYLUREA COMPOUNDS AND USE THEREOF SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2007-04-26 WO disclosed