SCHEMBL17469136

SCHEMBL17469136

C=COC(=O)N1Cc2ccccc2OC(c2ccc3ccccc3c2)C1

nearest known ligand 0.33

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 2/20 0.32
SLC6A4 P31645 2/20 0.32
SLC6A3 Q01959 2/20 0.32
DPP8 Q6V1X1 5/20 0.32
DPP9 Q86TI2 5/20 0.32
DPP7 Q9UHL4 4/20 0.32
KMT2A Q03164 2/20 0.31
MEN1 O00255 1/20 0.31
GABRA1 P14867 1/20 0.31
GABRB2 P47870 1/20 0.31
NPC1 O15118 1/20 0.31
RAB9A P51151 1/20 0.31
CYP19A1 P11511 1/20 0.31
PIK3CA P42336 1/20 0.31

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
SCHEMBL17468799 0.88 ALDH1A1 (0.40) SLC6A2SLC6A4SLC6A3NPC1RAB9A
SCHEMBL17468913 0.87 CYP19A1 (0.38) NPC1RAB9ACYP19A1
SCHEMBL17459385 0.85 TAS1R3 (0.38) KMT2AMEN1
SCHEMBL17468800 0.84 ALDH1A1 (0.35) NPC1RAB9ACYP19A1
SCHEMBL17468797 0.82 LTA4H (0.33) SLC6A2SLC6A4SLC6A3KMT2AGABRA1
SCHEMBL17469012 0.82 NAMPT (0.41)
SCHEMBL17469009 0.79 ABHD6 (0.34)
SCHEMBL17469002 0.79 ABHD6 (0.36) NPC1RAB9A
SCHEMBL17459478 0.78 SLC22A12 (0.34)
SCHEMBL17468798 0.78 TAS1R3 (0.38) DPP8DPP9DPP7NPC1RAB9A

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