SCHEMBL17469142

SCHEMBL17469142

C=COC(=O)N1Cc2c(OC)cccc2OC(c2ccc(Cl)cc2)C1

nearest known ligand 0.35

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MGLL Q99685 5/20 0.35
NR3C1 P04150 1/20 0.35
ALDH1A1 P00352 2/20 0.35
KDM4E B2RXH2 1/20 0.35
HPGD P15428 1/20 0.35
HSD17B10 Q99714 1/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
KIF11 P52732 1/20 0.34
DRD2 P14416 1/20 0.34
DRD4 P21917 1/20 0.34
MC4R P32245 1/20 0.34
ABHD6 Q9BV23 1/20 0.33
FFAR2 O15552 2/20 0.33
MAPT P10636 1/20 0.33
TSHR P16473 1/20 0.33
SMN1; SMN2 Q16637 2/20 0.33

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
SCHEMBL17468916 0.88 KIF11 (0.34) MGLLKIF11DRD2DRD4MAPT
SCHEMBL17468915 0.88 LTA4H (0.31) MGLL
SCHEMBL17468914 0.86 LTA4H (0.32)
SCHEMBL17469160 0.86 MGLL (0.35) MGLLMEN1KMT2AMAPT
SCHEMBL17469150 0.85 MGLL (0.35) MGLLNR3C1MEN1KMT2AMC4R
SCHEMBL17459385 0.82 TAS1R3 (0.38) MEN1KMT2A
SCHEMBL17469157 0.79 MAOB (0.38) ALDH1A1
SCHEMBL17469158 0.79 GABRA1 (0.39) ALDH1A1MEN1KMT2A
SCHEMBL17469006 0.78 RIPK1 (0.35) MEN1KMT2AKIF11
SCHEMBL17469112 0.75 KDM4E (0.38) ALDH1A1KDM4EHPGDHSD17B10DRD2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2016012333-A1 PESTICIDAL COMPOUNDS SYNGENTA PARTICIPATIONS AG (CH) 2016-01-28 WO disclosed