SCHEMBL28028469

SCHEMBL28028469

COCC1(OC(C)=O)CC(c2cc(Cl)cc(Cl)c2)=NO1

nearest known ligand 0.37

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CA1 P00915 1/20 0.37
CA2 P00918 1/20 0.37
KDM4E B2RXH2 1/20 0.35
RECQL P46063 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
SCHEMBL16959520 0.90 CA1 (0.40) CA1CA2KDM4ERECQL
SCHEMBL16959515 0.78 CA1 (0.39) CA1CA2
SCHEMBL12818958 0.76 CA1 (0.39) CA1CA2KDM4ERECQL
SCHEMBL28028470 0.76 CA1 (0.37) CA1CA2KDM4E
SCHEMBL16964254 0.71 CA1 (0.39) CA1CA2KDM4ERECQL
SCHEMBL21847506 0.70 CA1 (0.41) CA1CA2KDM4ERECQL
SCHEMBL22418743 0.70 CA1 (0.55) CA1CA2KDM4E
SCHEMBL12818924 0.70 CA1 (0.43) CA1CA2KDM4ERECQL
SCHEMBL16964250 0.70 CA1 (0.41) CA1CA2KDM4ERECQL
SCHEMBL24832639 0.69 CA1 (0.40) CA1CA2KDM4ERECQL

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
CN-104812739-A 3-phenylisoxazolin derivatives with herbicidal action BAYER CROPSCIENCE AG 2015-07-29 CN disclosed