SCHEMBL8750280

SCHEMBL8750280

C=CCOC(=O)OC1CC(=O)N(C)C1

nearest known ligand 0.39

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 4/20 0.39
KCNA3 P22001 1/20 0.35
GAA P10253 2/20 0.33
CYP19A1 P11511 1/20 0.33
FAAH O00519 1/20 0.32
MGLL Q99685 1/20 0.32
NPSR1 Q6W5P4 1/20 0.31
CYP3A4 P08684 1/20 0.31
ALDH1A1 P00352 2/20 0.31
TDP1 Q9NUW8 1/20 0.31
MAPKAPK2 P49137 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
SCHEMBL8750285 0.82 KCNA3 (0.32) KCNA3GAANPSR1CYP3A4
SCHEMBL793587 0.78 MEN1 (0.46) BRD4CYP3A4ALDH1A1TDP1
SCHEMBL793001 0.77 BRD4 (0.54) BRD4
SCHEMBL688823 0.73 BRD4 (0.49) BRD4
SCHEMBL18472043 0.73 BRD4 (0.49) BRD4
SCHEMBL14856811 0.73 BRD4 (0.49) BRD4
SCHEMBL17294389 0.73 BRD4 (0.49) BRD4
SCHEMBL21026694 0.73 BRD4 (0.49) BRD4
SCHEMBL5599867 0.72 KCNA3 (0.42) KCNA3GAANPSR1CYP3A4ALDH1A1
SCHEMBL20665982 0.72 BRD4 (0.45) BRD4

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
EP-0601321-B1 Binders composition for electrodeposition BASF LACKE & FARBEN (DE) 1997-02-19 EP disclosed
EP-0601321-A1 Binders composition for electrodeposition BASF Lacke + Farben AG (DE) 1994-06-15 EP disclosed