SCHEMBL9845448

SCHEMBL9845448

C=C1C2=C(CCCC2)C(=O)N1c1cc(C(=S)CC(=O)OC)c(Cl)cc1F

nearest known ligand 0.54

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
GRM7 Q14831 1/20 0.39
GRM4 Q14833 1/20 0.39

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
SCHEMBL9845459 0.92 PPOX (0.42) GRM7GRM4
SCHEMBL9845426 0.88 GRM7 (0.36) GRM7GRM4
SCHEMBL9845421 0.83 GRM7 (0.38) GRM7GRM4
SCHEMBL9845440 0.81 GRM7 (0.41) GRM7GRM4
SCHEMBL9845434 0.78 PPOX (0.38)
SCHEMBL9845427 0.78 PPOX (0.39)
SCHEMBL9765198 0.77 GRM7 (0.43) GRM7GRM4
SCHEMBL9845461 0.76 PPOX (0.36) GRM7GRM4
SCHEMBL9765503 0.76 GAA (0.43) GRM7GRM4
SCHEMBL9871821 0.76 GRM7 (0.43) GRM7GRM4

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0420810-A2 Herbicidal agents CIBA-GEIGY AG (CH) 1991-04-03 EP claimed
EP-0420810-A2 Herbicidal agents CIBA-GEIGY AG (CH) 1991-04-03 EP disclosed