SCHEMBL6903150

SCHEMBL6903150

CCCOC(=O)C(C)N(C(=O)c1ccccc1)c1ccc(F)c(Cl)c1

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.42
MDM4 O15151 2/20 0.40
MDM2 Q00987 2/20 0.40
NPC1 O15118 2/20 0.39
RAB9A P51151 1/20 0.39
PTGIR P43119 1/20 0.39
ALDH1A1 P00352 1/20 0.37
MEN1 O00255 1/20 0.37
PLA2G1B P04054 1/20 0.37
HTT P42858 1/20 0.37
KMT2A Q03164 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
ATG4B Q9Y4P1 1/20 0.37
TSPO P30536 1/20 0.37
USP2 O75604 1/20 0.36

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
SCHEMBL7619248 1.00 LMNA (0.42) LMNAMDM4MDM2NPC1RAB9A
SCHEMBL3455025 0.93 MDM4 (0.39) MDM4MDM2NPC1RAB9APTGIR
SCHEMBL3455372 0.92 CNR2 (0.38) LMNAMDM4MDM2NPC1RAB9A
SCHEMBL635894 0.91 RORC (0.43) LMNAMDM4MDM2NPC1RAB9A
SCHEMBL635895 0.91 RORC (0.43) LMNAMDM4MDM2NPC1RAB9A
SCHEMBL30519772 0.86 MEN1 (0.51) MDM4MDM2NPC1RAB9APTGIR
SCHEMBL55267 0.86 MEN1 (0.51) MDM4MDM2NPC1RAB9APTGIR
SCHEMBL29435442 0.86 MEN1 (0.51) MDM4MDM2NPC1RAB9APTGIR
SCHEMBL635027 0.86 MEN1 (0.51) MDM4MDM2NPC1RAB9APTGIR
SCHEMBL8827406 0.86 MEN1 (0.51) MDM4MDM2NPC1RAB9APTGIR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1423009-A2 HERBICIDES MADE FROM SUBSTITUTED ARYL KETONES Bayer CropScience AG (DE) 2004-06-02 EP disclosed
WO-2003017766-A2 HERBICIDES MADE FROM SUBSTITUTED ARYL KETONES BAYER CROPSCIENCE AG (DE) 2003-03-06 WO disclosed
WO-2003000058-A1 SELECTIVE HERBICIDES BASED ON PYRIMIDINE DERIVATIVES BAYER CROPSCIENCE AG (DE) 2003-01-03 WO disclosed