SCHEMBL9711069

SCHEMBL9711069

C#CCOc1cc(-n2c(C#N)c3n(c2=O)CCCC3O)c(F)cc1Cl

nearest known ligand 0.48

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
PPOX P50336 12/20 0.37
SCN9A Q15858 3/20 0.32

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
SCHEMBL9710757 0.90 PPOX (0.34) PPOX
SCHEMBL9710839 0.86 PPOX (0.46) PPOX
SCHEMBL9710848 0.82 PPOX (0.37) PPOX
SCHEMBL9710834 0.81 PPOX (0.36) PPOX
SCHEMBL9710829 0.78 PPOX (0.37) PPOXSCN9A
SCHEMBL9710650 0.77 CCR2 (0.35)
SCHEMBL9710864 0.76 PGK1 (0.37) PPOX
SCHEMBL9710827 0.76 PPOX (0.47) PPOX
SCHEMBL9710639 0.76 PPOX (0.47) PPOX
SCHEMBL9710587 0.76 PPOX (0.47) 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
WO-1992021662-A1 POSSIBLY CONDENSED PHENYLIMIDAZOLONES AND PYRIMIDINONES AS HERBICIDES; INTERMEDIATES DOWELANCO (US) 1992-12-10 WO claimed
WO-1992021662-A1 POSSIBLY CONDENSED PHENYLIMIDAZOLONES AND PYRIMIDINONES AS HERBICIDES; INTERMEDIATES DOWELANCO (US) 1992-12-10 WO disclosed