SCHEMBL8820570

SCHEMBL8820570

Cn1c(C(F)(F)F)cc(=O)n(Cc2cc(Cl)cc(Cl)c2Cl)c1=O

nearest known ligand 0.35

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
ALDH1A1 P00352 1/20 0.35
HPGD P15428 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.34
DPP4 P27487 3/20 0.33
DPP8 Q6V1X1 1/20 0.33
TSHR P16473 1/20 0.33
MAPK1 P28482 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
DDR1 Q08345 2/20 0.32
MTHFD2 P13995 1/20 0.31
TP53 P04637 1/20 0.31
P2RX7 Q99572 1/20 0.30
CMA1 P23946 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
SCHEMBL8819833 0.88 KMT2A (0.36) MEN1KMT2AALDH1A1HPGDL3MBTL1
SCHEMBL8818687 0.88 HPGD (0.39) MEN1KMT2AALDH1A1HPGDDPP4
SCHEMBL8574205 0.85 UBE2N (0.33) MEN1KMT2AALDH1A1HPGDL3MBTL1
SCHEMBL8607569 0.85 CMA1 (0.35) MEN1KMT2AALDH1A1HPGDTP53
SCHEMBL8819042 0.83 ALDH1A1 (0.39) MEN1KMT2AALDH1A1HPGDL3MBTL1
SCHEMBL7469280 0.78 HPGD (0.36) MEN1KMT2AALDH1A1HPGDL3MBTL1
SCHEMBL7475187 0.74 HPGD (0.62) MEN1KMT2AALDH1A1HPGDTSHR
SCHEMBL8820735 0.74 ALDH1A1 (0.43) MEN1KMT2AALDH1A1DDR1
SCHEMBL7470706 0.73 P2RX3 (0.39)
SCHEMBL7472788 0.71 RORC (0.42) MEN1KMT2AALDH1A1TSHRNPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-1997047607-A1 HERBICIDAL 3-(SUBSTITUTED-BENZYL)-1-METHYL-6-TRIFLUOROMETHYLURACILS FMC CORPORATION (US) 1997-12-18 WO disclosed
US-5683966-A Herbicidal 3-(substituted-benzyl)-1-methyl-6-trifluoromethyluracils FMC CORPORATION (US) 1997-11-04 US disclosed
US-5391541-A Herbicidal 3-(substituted-benzyl)-1-methyl-6-trifluoromethyluracils FMC CORPORATION (US) 1995-02-21 US disclosed
WO-1995004461-A1 HERBICIDAL 3-(SUBSTITUTED-BENZYL)-1-METHYL-6-TRIFLUOROMETHYLURACILS FMC CORPORATION (US) 1995-02-16 WO disclosed