SCHEMBL8948489

SCHEMBL8948489

Cn1c(C(F)(F)F)cc(=O)n(-c2ccc(Cl)c3c2OC(C)(C)C3)c1=O

nearest known ligand 0.34

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PTGES O14684 8/20 0.34
CYP1A2 P05177 2/20 0.31
CYP2C9 P11712 2/20 0.31
CYP2C19 P33261 2/20 0.31
ALOX5 P09917 1/20 0.31
ALDH1A1 P00352 1/20 0.31
POLB P06746 1/20 0.31
PGR P06401 1/20 0.30
ADRA1B P35368 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
SCHEMBL8948746 0.88 PTGES (0.31) PTGESALOX5
SCHEMBL8948604 0.86 FFAR4 (0.34) ALDH1A1
SCHEMBL9219310 0.82 PGR (0.32) PGR
SCHEMBL8948507 0.82 PTGES (0.35) PTGESALOX5
SCHEMBL8948552 0.80 PGR (0.35) PGR
SCHEMBL9220693 0.79
SCHEMBL8948790 0.79 BCAT1 (0.48)
SCHEMBL8948508 0.78 PGR (0.34) PGR
SCHEMBL8948499 0.77
SCHEMBL8948578 0.74 PTGES (0.32) PTGES

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
US-5521147-A HERBICIDES FMC CORPORATION (US) 1996-05-28 US disclosed
WO-1995005079-A1 3-(BENZOFURAN-7-YL)-6-HALOALKYLURACILS FMC CORPORATION (US) 1995-02-23 WO disclosed