SCHEMBL7306243

SCHEMBL7306243

CC(C)(C)OC(=O)OC1CC(c2ccc(N)cc2)CCN1

nearest known ligand 0.36

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 1/20 0.36
SLC6A3 Q01959 1/20 0.32
ELANE P08246 1/20 0.31
P2RY14 Q15391 1/20 0.31
NAMPT P43490 1/20 0.30
HRH3 Q9Y5N1 1/20 0.30
NR1H2 P55055 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
SCHEMBL8986416 0.80 SLC6A2 (0.37) SLC6A3
SCHEMBL27870985 0.72 HDAC2 (0.33)
SCHEMBL28825883 0.72 HDAC2 (0.33)
SCHEMBL7303971 0.69 SLC18A3 (0.42) KDM1AP2RY14NAMPTNR1H2
SCHEMBL8315816 0.69 MEN1 (0.32)
SCHEMBL3547219 0.68 NPC1 (0.40) NAMPTHRH3NR1H2
SCHEMBL3547216 0.68 NPC1 (0.40) NAMPTHRH3NR1H2
SCHEMBL8315133 0.68 GAA (0.33) SLC6A3
SCHEMBL22471554 0.67 CHRM2 (0.56) NAMPTHRH3NR1H2
SCHEMBL15378924 0.67 CHRM2 (0.56) NAMPTHRH3NR1H2

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-0657440-B1 Oxazolidine-2-one derivatives as MAO inhibitors HOFFMANN LA ROCHE (CH) 2000-04-05 EP disclosed
EP-0657440-A1 Oxazolidine-2-one derivatives F. HOFFMANN-LA ROCHE AG (CH) 1995-06-14 EP disclosed