SCHEMBL8015131

SCHEMBL8015131

CC(CCC[C]=O)C(N)=O

nearest known ligand 0.33

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CA1 P00915 3/20 0.33
CA2 P00918 1/20 0.33
LTA4H P09960 1/20 0.33
BLM P54132 1/20 0.32
GABRR1 P24046 2/20 0.32

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
SCHEMBL8014633 0.94 CA1 (0.36) CA1CA2LTA4HBLMGABRR1
SCHEMBL8048058 0.86
SCHEMBL15340966 0.81 BLM (0.44) CA1CA2LTA4HBLMGABRR1
SCHEMBL31236981 0.81 MAPT (0.38) CA1CA2LTA4HBLMGABRR1
SCHEMBL19681245 0.79
SCHEMBL9763558 0.79 CA1 (0.44) CA1CA2LTA4HBLMGABRR1
SCHEMBL5816226 0.77 CA1 (0.43) CA1CA2LTA4HBLMGABRR1
SCHEMBL21341374 0.76 CA1 (0.39) CA1CA2LTA4HBLMGABRR1
SCHEMBL8002556 0.75 CA2 (0.64) CA1CA2
SCHEMBL25924884 0.75 USP2 (0.41) CA1CA2LTA4HBLMGABRR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6117822-A AS HERBICIDES AND PLANT DESICCANTS AND/OR DEFOLIANTS BASF AKTIENGESELLSCHAFT (DE) 2000-09-12 US disclosed
EP-0788479-B1 SUBSTITUTED PHTHALIMIDO-CINNAMIC ACID DERIVATIVES WITH HERBICIDAL EFFECT BASF AG (DE) 2000-04-19 EP disclosed
EP-0939078-A2 Substituted phthalimido-cinnamic acid derivatives with herbicidal activity BASF AKTIENGESELLSCHAFT (DE) 1999-09-01 EP disclosed
US-5807807-A HERBICIDES BASF AKTIENGESELLSCHAFT (DE) 1998-09-15 US disclosed
US-5707937-A AGRICULTURAL HERBICIDES, DESICCANTS, DEFOLIANTS, HARVESTING AIDS BASF AKTIENGESELLSCHAFT (DE) 1998-01-13 US disclosed
WO-1996014298-A1 SUBSTITUTED PHTHALIMIDO-CINNAMIC ACID DERIVATIVES WITH HERBICIDAL EFFECT BASF AKTIENGESELLSCHAFT (DE) 1996-05-17 WO disclosed