SCHEMBL9870773

SCHEMBL9870773

C#CCOc1cc(N2C(=O)C3=C(CCCC3)C2=O)c(F)cc1C

nearest known ligand 0.75

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
GRM7 Q14831 4/20 0.43
GRM4 Q14833 4/20 0.43
GRM1 Q13255 1/20 0.43
PPOX P50336 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
SCHEMBL29448833 0.86 PPOX (0.51) PPOX
SCHEMBL314005 0.86 PPOX (0.51) PPOX
SCHEMBL10510772 0.81 PPOX (0.53) GRM7GRM4GRM1PPOX
SCHEMBL10581434 0.79 PPOX (0.47) PPOX
SCHEMBL10513071 0.78 PPOX (0.52) GRM7GRM4GRM1PPOX
SCHEMBL10482962 0.78 GRM7 (0.43) GRM7GRM4GRM1PPOX
SCHEMBL10510123 0.77 GRM7 (0.43) GRM7GRM4GRM1
SCHEMBL10470799 0.76 PPOX (0.51) PPOX
SCHEMBL6864571 0.75 PPOX (0.53) PPOX
SCHEMBL11038400 0.75 PPOX (0.54) PPOX

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
US-5045108-A Herbicidal and plant growth-regulating N-aryl-pyrrol-L-one and isoindol-2-one compounds BAYER AKTIENGESELLSCHAFT (DE) 1991-09-03 US disclosed
EP-0403891-A1 N-Aryl-nitrogen-heterocyclic compounds BAYER AG (DE) 1990-12-27 EP disclosed