SCHEMBL9765196

SCHEMBL9765196

CCOC(=O)[C@H](C)SC(=O)c1cc(N2C(=O)C3=C(CCCC3)C2=O)c(Cl)cc1Cl

nearest known ligand 0.50

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PPOX P50336 3/20 0.40
GAA P10253 1/20 0.36
PKM P14618 1/20 0.36
GRM7 Q14831 1/20 0.35
GRM4 Q14833 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
SCHEMBL9765200 0.91 PPOX (0.46) PPOX
SCHEMBL9765218 0.84 KMT2A (0.38) PPOX
SCHEMBL9765182 0.83 GRM7 (0.41) PPOXGRM7GRM4
SCHEMBL9765202 0.79 PPOX (0.43) PPOXGRM7GRM4
SCHEMBL11015583 0.78 PPOX (0.57) PPOXGAAPKM
SCHEMBL9765168 0.76 GRM7 (0.36) PPOXGRM7GRM4
SCHEMBL9765188 0.76 KDM4E (0.35) GAA
SCHEMBL9765185 0.76 KDM4E (0.35)
SCHEMBL9765201 0.75 GAA (0.39) PPOXGAAPKMGRM7GRM4
SCHEMBL9765184 0.74 PPOX (0.44) PPOXGRM7GRM4

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-0233151-B1 ESTERS AS HERBICIDES CIBA-GEIGY AG (CH) 1991-11-13 EP claimed