SCHEMBL4026747

SCHEMBL4026747

Cn1cc(OC(=O)Nc2cc(Cl)ccc2-c2ccccc2)c(C(F)(F)C(F)(F)F)c1

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
FABP4 P15090 3/20 0.41
MEN1 O00255 3/20 0.40
KMT2A Q03164 3/20 0.40
IDH2 P48735 3/20 0.40
FABP5 Q01469 1/20 0.39
NPSR1 Q6W5P4 2/20 0.39
KDM4E B2RXH2 1/20 0.39
ALDH1A1 P00352 1/20 0.39
CHRM3 P20309 3/20 0.38
IRAK4 Q9NWZ3 1/20 0.38
GRIK1 P39086 1/20 0.37
NPC1 O15118 1/20 0.36
PPARG P37231 1/20 0.36
MAPT P10636 2/20 0.36
IGF1R P08069 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.35
S1PR1 P21453 1/20 0.35
S1PR3 Q99500 1/20 0.35

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
SCHEMBL4034185 0.82 CHRM3 (0.48) MEN1KMT2ACHRM3
SCHEMBL4023822 0.80 CHRM3 (0.48) CHRM3
SCHEMBL4031745 0.80 FABP4 (0.39) FABP4IDH2FABP5NPSR1KDM4E
SCHEMBL4031806 0.75 CHRM3 (0.41) MEN1KMT2ACHRM3MAPT
SCHEMBL5710619 0.71 CHRM3 (0.41) NPSR1CHRM3NPC1
SCHEMBL4027201 0.70 CHRM3 (0.49) MEN1KMT2ANPSR1KDM4EALDH1A1
SCHEMBL4026463 0.70 CHRM3 (0.52) MEN1KMT2AALDH1A1CHRM3
SCHEMBL4031163 0.69 CHRM3 (0.46) MEN1KMT2ANPSR1CHRM3SMN1; SMN2
SCHEMBL4026961 0.69 CHRM3 (0.48) MEN1KMT2ANPSR1KDM4EALDH1A1
SCHEMBL4025520 0.69 CHRM3 (0.49) MEN1KMT2ACHRM3

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