SCHEMBL3705074

SCHEMBL3705074

C=CCN1CC2CCC1(C(NC(=O)c1cccc(C(F)(F)F)c1Cl)c1cccc(-c3cnn(C)c3)c1)CC2

nearest known ligand 0.59

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
SLC6A9 P48067 20/20 0.59

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
SCHEMBL3705077 1.00 SLC6A9 (0.59) SLC6A9
SCHEMBL3783295 0.89 SLC6A9 (0.75) SLC6A9
SCHEMBL4177252 0.85 SLC6A9 (0.73) SLC6A9
SCHEMBL3783022 0.81 SLC6A9 (0.54) SLC6A9
SCHEMBL3783021 0.81 SLC6A9 (0.54) SLC6A9
SCHEMBL17684559 0.80 SLC6A9 (0.51) SLC6A9
SCHEMBL4798581 0.78 SLC6A9 (0.58) SLC6A9
SCHEMBL4798569 0.78 SLC6A9 (0.58) SLC6A9
SCHEMBL3784094 0.78 SLC6A9 (0.73) SLC6A9
SCHEMBL3782488 0.76 SLC6A9 (0.48) SLC6A9

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-2010087761-A1 2-AZA-BICYCLO[2.2.2]OCTANE COMPOUNDS AND USES THEREOF ASTRAZENECA AB (SE) 2010-08-05 WO disclosed