SCHEMBL8948746

SCHEMBL8948746

CC1(C)Cc2c(Cl)ccc(-n3c(=O)cc(C(F)(F)F)n(N)c3=O)c2O1

nearest known ligand 0.31

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
PTGES O14684 4/20 0.31
ALOX5 P09917 1/20 0.31

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
SCHEMBL8948489 0.88 PTGES (0.34) PTGESALOX5
SCHEMBL8783930 0.83
SCHEMBL8948787 0.81 PGR (0.33)
SCHEMBL8783781 0.78
SCHEMBL8948790 0.78 BCAT1 (0.48)
SCHEMBL8948604 0.75 FFAR4 (0.34)
SCHEMBL8948507 0.71 PTGES (0.35) PTGESALOX5
SCHEMBL5387250 0.70 BCAT2 (0.34)
SCHEMBL9219310 0.70 PGR (0.32)
SCHEMBL8948552 0.70 PGR (0.35)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5521147-A HERBICIDES FMC CORPORATION (US) 1996-05-28 US disclosed