SCHEMBL7955801

SCHEMBL7955801

C=CCOC(=O)C=Cc1cc(-n2c(=O)cc(C(F)(F)F)n(C)c2=O)c(F)cc1Cl

nearest known ligand 0.33

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
APP P05067 1/20 0.33
PPOX P50336 1/20 0.31
ALDH1A1 P00352 1/20 0.30

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
SCHEMBL7955799 1.00 APP (0.33) APPPPOXALDH1A1
SCHEMBL7951761 0.90 PKM (0.35) PPOXALDH1A1
SCHEMBL7951759 0.90 PKM (0.35) PPOXALDH1A1
SCHEMBL7951701 0.87 XPO1 (0.33)
SCHEMBL7951700 0.87 XPO1 (0.33)
SCHEMBL10698389 0.84 CYP1A2 (0.33)
SCHEMBL8543133 0.79 PPOX (0.46) PPOX
SCHEMBL25359513 0.78
SCHEMBL7718512 0.78 PPOX (0.30) PPOX
SCHEMBL30084589 0.77

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
US-6207830-B1 REACTING AN ISOCYANATE WITH AN ENAMINE IN PRESENCE OF A BASE SYNGENTA CROP PROTECTION, INC. 2001-03-27 US claimed
EP-0831091-A2 Process for the production of 3-aryl-uracils Novartis AG (CH) 1998-03-25 EP claimed
US-6207830-B1 REACTING AN ISOCYANATE WITH AN ENAMINE IN PRESENCE OF A BASE SYNGENTA CROP PROTECTION, INC. 2001-03-27 US disclosed
EP-0831091-A2 Process for the production of 3-aryl-uracils Novartis AG (CH) 1998-03-25 EP disclosed