SCHEMBL3671693

SCHEMBL3671693

Fc1cc(CN(c2ccoc2)C2CC2)cnc1Br

nearest known ligand 0.32

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CTSL P07711 3/20 0.32
SLC6A2 P23975 1/20 0.31
SLC6A4 P31645 1/20 0.31
SLC6A3 Q01959 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
SCHEMBL4063378 0.86 CTSL (0.32) CTSLSLC6A2SLC6A4SLC6A3
SCHEMBL3667225 0.76
SCHEMBL2896122 0.73 CTSL (0.30) CTSL
SCHEMBL1165737 0.73 CTSL (0.30) CTSL
SCHEMBL327160 0.61 CTSL (0.30) CTSL
SCHEMBL3586153 0.61
SCHEMBL15895190 0.61
SCHEMBL1165788 0.60
SCHEMBL2893043 0.60 NR3C2 (0.32)
SCHEMBL22031726 0.60 RXRA (0.35)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2154957-A1 INSECTICIDE COMPOSITIONS HAVING AN IMPROVED EFFECT Bayer CropScience AG (DE) 2010-02-24 EP disclosed
WO-2009118025-A1 METHOD FOR CONTROLLING ANIMAL PEST AND PLANT PATHOGENIC FUNGI BY APPLYING AN AGROCHEMICAL COMPOSITION INTO THE CULTURE MEDIUM, SUITABLE FORMULATION AND USE THEREOF BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2009-10-01 WO disclosed
WO-2009118027-A1 SUSPENSION CONCENTRATES FOR IMPROVING ROOT UPTAKE OF AGROCHEMICALLY ACTIVE COMPOUNDS BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2009-10-01 WO disclosed
WO-2008148483-A1 INSECTICIDE COMPOSITIONS HAVING AN IMPROVED EFFECT BAYER CROPSCIENCE AG (DE) 2008-12-11 WO disclosed