SCHEMBL4031806

SCHEMBL4031806

Cn1cc(OC(=O)Nc2cc(Cl)ccc2-c2cccc(Cl)c2)c(C(F)F)c1

nearest known ligand 0.41

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CHRM3 P20309 16/20 0.41
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
CHRM2 P08172 2/20 0.38
CHRM1 P11229 2/20 0.38
MAPT P10636 1/20 0.36
HSP90AA1 P07900 1/20 0.36
HSP90AB1 P08238 1/20 0.36

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
SCHEMBL4025520 0.92 CHRM3 (0.49) CHRM3MEN1KMT2ACHRM2CHRM1
SCHEMBL4025092 0.85 CHRM3 (0.49) CHRM3CHRM2CHRM1
SCHEMBL4031163 0.82 CHRM3 (0.46) CHRM3MEN1KMT2ACHRM2CHRM1
SCHEMBL4027584 0.81 CHRM3 (0.50) CHRM3CHRM2CHRM1
SCHEMBL4026463 0.77 CHRM3 (0.52) CHRM3MEN1KMT2ACHRM1
SCHEMBL4028248 0.76 CHRM3 (0.52) CHRM3CHRM1
SCHEMBL4024951 0.76 CHRM3 (0.44) CHRM3MEN1KMT2ACHRM2CHRM1
SCHEMBL4026747 0.75 FABP4 (0.41) CHRM3MEN1KMT2AMAPT
SCHEMBL4028003 0.75 CHRM3 (0.48) CHRM3CHRM2CHRM1
SCHEMBL3037326 0.74 CHRM3 (0.48) CHRM3MEN1KMT2ACHRM2CHRM1

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