SCHEMBL8819833

SCHEMBL8819833

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

nearest known ligand 0.36

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.36
MEN1 O00255 2/20 0.36
ALDH1A1 P00352 1/20 0.36
HPGD P15428 1/20 0.33
NPSR1 Q6W5P4 2/20 0.32
DPP4 P27487 3/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
MAPK1 P28482 1/20 0.31
DPP8 Q6V1X1 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
SCHEMBL8820570 0.88 MEN1 (0.35) KMT2AMEN1ALDH1A1HPGDNPSR1
SCHEMBL8818687 0.85 HPGD (0.39) KMT2AMEN1ALDH1A1HPGDNPSR1
SCHEMBL8607569 0.83 CMA1 (0.35) KMT2AMEN1ALDH1A1HPGD
SCHEMBL8819042 0.81 ALDH1A1 (0.39) KMT2AMEN1ALDH1A1HPGDNPSR1
SCHEMBL8574205 0.76 UBE2N (0.33) KMT2AMEN1ALDH1A1HPGDL3MBTL1
SCHEMBL7469280 0.76 HPGD (0.36) KMT2AMEN1ALDH1A1HPGDNPSR1
SCHEMBL7475187 0.72 HPGD (0.62) KMT2AMEN1ALDH1A1HPGD
SCHEMBL7470706 0.71 P2RX3 (0.39)
SCHEMBL7472788 0.69 RORC (0.42) KMT2AMEN1ALDH1A1NPSR1
SCHEMBL7476563 0.69 LMNA (0.36) KMT2AMEN1ALDH1A1HPGDNPSR1

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