SCHEMBL4030601

SCHEMBL4030601

Cn1cc(OC(=O)Nc2ccccc2-c2ccc(Cl)c(Cl)c2)c(C2CC2)c1

nearest known ligand 0.56

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CHRM3 P20309 20/20 0.56
CHRM2 P08172 1/20 0.42
CHRM1 P11229 1/20 0.42

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
SCHEMBL4028195 0.89 CHRM3 (0.53) CHRM3CHRM2CHRM1
SCHEMBL4031110 0.88 CHRM3 (0.56) CHRM3CHRM2CHRM1
SCHEMBL4023857 0.86 CHRM3 (0.51) CHRM3CHRM2CHRM1
SCHEMBL4030379 0.86 CHRM3 (0.56) CHRM3
SCHEMBL4030355 0.85 CHRM3 (0.52) CHRM3CHRM2CHRM1
SCHEMBL4027573 0.85 CHRM3 (0.54) CHRM3CHRM2CHRM1
SCHEMBL4024486 0.84 CHRM3 (0.56) CHRM3
SCHEMBL4024550 0.82 CHRM3 (0.52) CHRM3CHRM2CHRM1
SCHEMBL4034185 0.80 CHRM3 (0.48) CHRM3CHRM2CHRM1
SCHEMBL4033789 0.80 CHRM3 (0.53) 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