SCHEMBL4031785

SCHEMBL4031785

Cn1cc(CF)c(OC(=O)Nc2ccccc2-c2ccccc2F)c1

nearest known ligand 0.48

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CHRM3 P20309 16/20 0.48
RAB9A P51151 2/20 0.40
NPC1 O15118 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
LMNA P02545 1/20 0.37
FAAH O00519 2/20 0.37

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
SCHEMBL4030244 0.88 CHRM3 (0.46) CHRM3
SCHEMBL4025143 0.87 CHRM3 (0.50) CHRM3LMNA
SCHEMBL4024233 0.86 CHRM3 (0.52) CHRM3
SCHEMBL4031383 0.85 CHRM3 (0.48) CHRM3RAB9ANPC1NPSR1LMNA
SCHEMBL4026096 0.84 CHRM3 (0.52) CHRM3
SCHEMBL4026961 0.84 CHRM3 (0.48) CHRM3NPSR1
SCHEMBL4025589 0.82 CHRM3 (0.46) CHRM3RAB9ANPC1NPSR1
SCHEMBL4024550 0.81 CHRM3 (0.52) CHRM3
SCHEMBL4028248 0.81 CHRM3 (0.52) CHRM3
SCHEMBL4033789 0.81 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