SCHEMBL8948599

SCHEMBL8948599

Nc1c(F)cc(Cl)c2c1OCC=C2

nearest known ligand 0.33

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
CA9 Q16790 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
SCHEMBL6823514 0.87 CA1 (0.34) CA1CA2CA9
SCHEMBL1477746 0.70 CA1 (0.30) CA1CA9
SCHEMBL9222358 0.69 CA1 (0.35) CA1CA2CA9
SCHEMBL1477385 0.69 CA1 (0.34) CA1CA9
SCHEMBL8948504 0.68 PDE4D (0.36) CA1CA9
SCHEMBL7395299 0.66 HTT (0.33) CA1CA2CA9
SCHEMBL1362915 0.65 CA1 (0.34) CA1CA9
SCHEMBL8948549 0.63 ACHE (0.38)
SCHEMBL8299325 0.62 MAPT (0.39) CA1CA2CA9
SCHEMBL21955322 0.62 GYS1 (0.30)

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