SCHEMBL7733763

SCHEMBL7733763

CC(C)OC(=O)C(Cl)Cc1cc(N2C(=O)c3ccccc3C2=O)c(F)cc1Cl

nearest known ligand 0.45

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.39
AGTR1 P30556 1/20 0.39
KMT2A Q03164 2/20 0.38
MEN1 O00255 1/20 0.38
PPOX P50336 1/20 0.37
GRM1 Q13255 5/20 0.37
GRM4 Q14833 2/20 0.37
MAPT P10636 1/20 0.37
LMNA P02545 1/20 0.37
TP53 P04637 1/20 0.37
PLA2G1B P04054 1/20 0.36
ATG4B Q9Y4P1 1/20 0.36
CYP3A4 P08684 1/20 0.36
NFKB1 P19838 1/20 0.36
PMP22 Q01453 1/20 0.36
HSD17B10 Q99714 1/20 0.35
TSHR P16473 1/20 0.35

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
SCHEMBL7729709 0.90 GRM1 (0.39) KMT2AMEN1GRM1GRM4MAPT
SCHEMBL7729726 0.90 PPOX (0.42) KMT2AMEN1PPOXGRM1GRM4
SCHEMBL7734095 0.85 ALDH1A1 (0.39) ALDH1A1KMT2AMEN1GRM1GRM4
SCHEMBL7734263 0.85 CYP3A4 (0.39) KMT2AMEN1GRM1GRM4CYP3A4
SCHEMBL7734418 0.81 GRM1 (0.44) KMT2AMEN1PPOXGRM1GRM4
SCHEMBL7729011 0.81 KMT2A (0.38) KMT2AMEN1PPOXGRM1GRM4
SCHEMBL7767630 0.74 PPOX (0.46) PPOXGRM4
SCHEMBL8020623 0.73 KMT2A (0.41) ALDH1A1KMT2AMEN1GRM1MAPT
SCHEMBL7729245 0.72 MEN1 (0.41) KMT2AMEN1PPOXGRM1MAPT
SCHEMBL7729242 0.72 MEN1 (0.41) KMT2AMEN1PPOXGRM1MAPT

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
US-6365753-B1 EXCELLENT PREFERENTIAL EFFECTS ON WEEDS; GRASSES; NONPHYTOTOXIC TO CROPS E.G. WHEAT; BARLEY; CORN MITSUBISHI CHEMICAL CORPORATION (JP) 2002-04-02 US disclosed
EP-1097923-A1 PHTHALIMIDES AND HERBICIDE CONTAINING THE SAME AS ACTIVE COMPONENT MITSUBISHI CHEMICAL CORPORATION (JP) 2001-05-09 EP disclosed