SCHEMBL4636985

SCHEMBL4636985

COc1ccccc1CN(C(=O)c1cccc(F)c1F)C(=O)N(C)c1ccc(SC(F)(F)F)cc1F

nearest known ligand 0.39

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
RXFP1 Q9HBX9 3/20 0.39
HPGD P15428 2/20 0.36
GAA P10253 1/20 0.36
NPC1 O15118 2/20 0.36
MAPT P10636 3/20 0.35
RAB9A P51151 1/20 0.35
MEN1 O00255 5/20 0.35
KMT2A Q03164 5/20 0.35
CRHBP P24387 1/20 0.35
CRHR2 Q13324 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
ABCB1 P08183 1/20 0.35
ABCC1 P33527 1/20 0.35
NLRP3 Q96P20 1/20 0.34
PDE10A Q9Y233 1/20 0.33
TSPO P30536 1/20 0.33
GPBAR1 Q8TDU6 1/20 0.33

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
SCHEMBL4166771 0.90 RXFP1 (0.36) RXFP1HPGDGAANPC1MAPT
SCHEMBL4636946 0.83 RXFP1 (0.34) RXFP1MAPTABCB1ABCC1GPBAR1
SCHEMBL4636459 0.81 LMNA (0.37) HPGDMAPT
SCHEMBL4636222 0.80 CES2 (0.35) RXFP1HPGDMAPTABCB1ABCC1
SCHEMBL4636993 0.80 CES2 (0.31) MAPTGPBAR1
SCHEMBL4636452 0.80 CES2 (0.31) MAPTGPBAR1
SCHEMBL4637560 0.77 PPARG (0.34) RXFP1HPGDGAAMAPTRAB9A
SCHEMBL4157346 0.76 HPGD (0.47) HPGDGAANPC1RAB9AMEN1
SCHEMBL4150006 0.75 MEN1 (0.43) HPGDGAAMAPTMEN1KMT2A
SCHEMBL4159030 0.75 TDP1 (0.45) HPGDGAAMAPTRAB9AMEN1

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