SCHEMBL9475101

SCHEMBL9475101

C=CCOc1cc(N2C(=O)C3=CCCCN3C2=O)c(F)cc1C#N

nearest known ligand 0.39

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
PPOX P50336 7/20 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
SCHEMBL9473703 0.81 ALDH1A1 (0.32)
SCHEMBL9387314 0.78 PPOX (0.52) PPOX
SCHEMBL9384103 0.74 PPOX (0.41) PPOX
SCHEMBL9474632 0.72 PPOX (0.38) PPOX
SCHEMBL9693054 0.69 PPOX (0.37) PPOX
SCHEMBL8362119 0.67 HTR2C (0.39)
SCHEMBL6696956 0.65 BCAT2 (0.41) PPOX
SCHEMBL10413186 0.65
SCHEMBL10510772 0.64 PPOX (0.53) PPOX
SCHEMBL6494928 0.64 BCAT2 (0.35) 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5069711-A PREEMERGENCE BAYER AKTIENGESELLSCHAFT (DE) 1991-12-03 US claimed
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