SCHEMBL4709916

SCHEMBL4709916

CC(=O)N1CCN(CCCN2C(=O)c3ccccc3C2=O)CC1

nearest known ligand 0.64

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ MAOB P27338 4/20 0.64
▸ KDM1A O60341 1/20 0.62
▸ HTR1A P08908 4/20 0.62
▸ ALDH1A1 P00352 2/20 0.60
▸ DRD2 P14416 1/20 0.57
▸ DRD3 P35462 1/20 0.57

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
SCHEMBL4715710 0.87 HTR1A (0.68) MAOBHTR1AALDH1A1DRD2DRD3
SCHEMBL13469510 0.86 HTR1A (0.79) MAOBHTR1ADRD2DRD3
SCHEMBL1275567 0.84 HTR1A (0.68) MAOBHTR1AALDH1A1DRD2DRD3
SCHEMBL10850210 0.84 MAOB (0.59) MAOBHTR1AALDH1A1DRD2DRD3
SCHEMBL7972938 0.83 ALDH1A1 (0.70) MAOBHTR1AALDH1A1DRD2
SCHEMBL1532232 0.83 MAOB (0.73) MAOBHTR1ADRD2DRD3
SCHEMBL14028451 0.83 HTR1A (0.79) MAOBHTR1ADRD2DRD3
SCHEMBL10857215 0.82 HTR1A (0.68) MAOBHTR1ADRD2DRD3
SCHEMBL6946848 0.82 MAOB (0.71) MAOBHTR1ADRD2DRD3
SCHEMBL17844904 0.82 DRD2 (0.56) MAOBHTR1AALDH1A1DRD2DRD3

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-1991528-A2 MODULATORS OF ALPHA7 NICOTINIC ACETYLCHOLINE RECEPTORS AND THERAPEUTIC USES THEREOF Siena Biotech S.p.A. (IT) 2008-11-19 — — EP disclosed
WO-2007098826-A2 MODULATORS OF ALPHA7 NICOTINIC ACETYLCHOLINE RECEPTORS AND THERAPEUTIC USES THEREOF SIENA BIOTECH S.P.A. (IT) 2007-09-07 — — WO disclosed
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