SCHEMBL4026096

SCHEMBL4026096

Cn1cc(CF)c(OC(=O)Nc2ccccc2-c2cccc(F)c2)c1

nearest known ligand 0.52

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CHRM3 P20309 19/20 0.52
DRD2 P14416 1/20 0.44
DRD4 P21917 1/20 0.44
DRD3 P35462 1/20 0.44

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
SCHEMBL4028248 0.89 CHRM3 (0.52) CHRM3
SCHEMBL4025143 0.89 CHRM3 (0.50) CHRM3
SCHEMBL4024233 0.88 CHRM3 (0.52) CHRM3
SCHEMBL4027799 0.86 CHRM3 (0.52) CHRM3DRD2DRD4DRD3
SCHEMBL4024550 0.85 CHRM3 (0.52) CHRM3
SCHEMBL4031785 0.84 CHRM3 (0.48) CHRM3
SCHEMBL4027584 0.84 CHRM3 (0.50) CHRM3DRD2DRD4DRD3
SCHEMBL4026961 0.83 CHRM3 (0.48) CHRM3
SCHEMBL4024486 0.83 CHRM3 (0.56) CHRM3
SCHEMBL4030244 0.81 CHRM3 (0.46) CHRM3

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
EP-1252140-B1 PYRROLECARBOXAMIDES AND PYRROLETHIOAMIDES AS FUNGICIDES SYNGENTA PARTICIPATIONS AG (CH) 2009-05-13 EP claimed