SCHEMBL5315841

SCHEMBL5315841

CCCNC(=O)N(COC)c1ccc(SC(F)(F)F)cc1F

nearest known ligand 0.37

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.37
POLB P06746 2/20 0.37
HPGD P15428 1/20 0.37
MCHR1 Q99705 1/20 0.36
PTPRZ1 P23471 1/20 0.33
EPHX2 P34913 1/20 0.32
NR1H4 Q96RI1 1/20 0.32
PDE2A O00408 2/20 0.32
UBE2M P61081 1/20 0.32
DCUN1D1 Q96GG9 1/20 0.32
KCNK2 O95069 2/20 0.31
GAA P10253 1/20 0.31
KCNK10 P57789 1/20 0.31
KMT2A Q03164 3/20 0.31
MEN1 O00255 2/20 0.31
HSD17B10 Q99714 1/20 0.31

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
SCHEMBL5314828 0.89 MCHR1 (0.37) ALDH1A1MCHR1PTPRZ1EPHX2NR1H4
SCHEMBL5314377 0.89 MCHR1 (0.33) HPGDMCHR1PTPRZ1EPHX2NR1H4
SCHEMBL5314131 0.86 TSHR (0.34) ALDH1A1MCHR1PTPRZ1EPHX2NR1H4
SCHEMBL5311672 0.86 PTPRZ1 (0.32) MCHR1PTPRZ1EPHX2NR1H4PDE2A
SCHEMBL5315475 0.85 MCHR1 (0.35) ALDH1A1HPGDMCHR1PTPRZ1EPHX2
SCHEMBL5314000 0.85 MTNR1A (0.40) ALDH1A1POLBHPGDGAAKMT2A
SCHEMBL5313318 0.84 MAPT (0.42) ALDH1A1HPGDPTPRZ1EPHX2NR1H4
SCHEMBL5312106 0.80 TRPA1 (0.35) POLBMCHR1PDE2AKCNK2KCNK10
SCHEMBL13774526 0.78 MCHR1 (0.37) ALDH1A1HPGDMCHR1PTPRZ1EPHX2
SCHEMBL5314173 0.78 KDM4E (0.35) ALDH1A1HPGDGAA

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