SCHEMBL9385035

SCHEMBL9385035

N#Cc1cc(F)c(N2C(=O)C3=C(CCCC3)C2=O)cc1O

nearest known ligand 0.49

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
GRM7 Q14831 4/20 0.42
GRM4 Q14833 4/20 0.42
GRM1 Q13255 1/20 0.42
PPOX P50336 1/20 0.41

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
SCHEMBL9870787 0.91 PPOX (0.38) GRM7GRM4GRM1PPOX
SCHEMBL7652449 0.87 GRM7 (0.42) GRM7GRM4GRM1
SCHEMBL9514262 0.83 GRM7 (0.43) GRM7GRM4GRM1
SCHEMBL9517807 0.82 GRM7 (0.42) GRM7GRM4GRM1
SCHEMBL9736984 0.81 ALDH1A1 (0.44) GRM7GRM4
SCHEMBL7170081 0.79 ESR1 (0.46) GRM7GRM4GRM1
SCHEMBL8215400 0.79 BCAT2 (0.42) GRM7GRM4GRM1
SCHEMBL5318631 0.78 GRM7 (0.46) GRM7GRM4PPOX
SCHEMBL9444941 0.78 PPOX (0.64) GRM7GRM4GRM1PPOX
SCHEMBL30566778 0.78 GRM7 (0.46) GRM7GRM4PPOX

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0364797-B1 N-aryl-nitrogenated heterocycles, process for their preparation and their use as herbicides BAYER AG (DE) 1994-02-16 EP disclosed
US-5221318-A Crop plant selectivity BAYER AKTIENGESELLSCHAFT (DE) 1993-06-22 US disclosed
US-5069711-A PREEMERGENCE BAYER AKTIENGESELLSCHAFT (DE) 1991-12-03 US disclosed
EP-0364797-A2 N-aryl-nitrogenated heterocycles, process for their preparation and their use as herbicides BAYER AG (DE) 1990-04-25 EP disclosed