SCHEMBL17468804

SCHEMBL17468804

Clc1ccc(C2CNCc3c(Cl)cccc3O2)cc1

nearest known ligand 0.39

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PNMT P11086 1/20 0.36
GUSB P08236 1/20 0.35
HTR3A P46098 1/20 0.34
POLB P06746 1/20 0.34
LDHA P00338 1/20 0.34
SLC6A2 P23975 2/20 0.33
SLC6A3 Q01959 1/20 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
SCHEMBL17468802 0.86 KIF11 (0.35) GUSBHTR3APOLBSLC6A2SLC6A3
SCHEMBL17468758 0.83 CHRNB2 (0.33) GUSBPOLB
SCHEMBL17468805 0.83 KDM4E (0.41) PNMTGUSBHTR3A
SCHEMBL17459280 0.79 GUSB (0.41) GUSBHTR3APOLBSLC6A2SLC6A3
SCHEMBL17459292 0.74 ESR1 (0.40) PNMTHTR3ASLC6A2SLC6A3
SCHEMBL18325494 0.72 PNMT (0.37) PNMT
SCHEMBL17469110 0.69 DRD3 (0.36)
SCHEMBL17468806 0.67 MAOB (0.44)
SCHEMBL17468765 0.67 SLC6A4 (0.38) HTR3A
SCHEMBL17468757 0.67 MAOB (0.44)

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