SCHEMBL7720436

SCHEMBL7720436

CC(=O)Nc1cccc(C2=CC3CCCC(C2)N3C)c1

nearest known ligand 0.53

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 3/20 0.53
SLC6A4 P31645 3/20 0.53
SLC6A3 Q01959 3/20 0.53
ALDH1A1 P00352 2/20 0.42
KDM4E B2RXH2 1/20 0.42
HPGD P15428 1/20 0.42
HSD17B10 Q99714 1/20 0.42
HRH3 Q9Y5N1 1/20 0.42
NQO2 P16083 2/20 0.41
GRIA2 P42262 2/20 0.41
ALPL P05186 1/20 0.41
ALPI P09923 1/20 0.41
ALPG P10696 1/20 0.41
KMT2A Q03164 1/20 0.41
BRD4 O60885 1/20 0.41
CREBBP Q92793 1/20 0.41
KCNH2 Q12809 1/20 0.40

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
Acetic Acid SCHEMBL7215844 0.98 SLC6A2 (0.54) SLC6A2SLC6A4SLC6A3ALDH1A1KDM4E
SCHEMBL6501184 0.93 SLC6A2 (0.62) SLC6A2SLC6A4SLC6A3ALDH1A1HSD17B10
SCHEMBL7210015 0.77 SLC6A2 (0.61) SLC6A2SLC6A4SLC6A3ALDH1A1HPGD
SCHEMBL7210006 0.74 SLC6A2 (0.57) SLC6A2SLC6A4SLC6A3
Oxalic Acid SCHEMBL7214943 0.74 SLC6A3 (0.54) SLC6A2SLC6A4SLC6A3
SCHEMBL11988478 0.71 SLC6A2 (0.64) SLC6A2SLC6A4SLC6A3BRD4CREBBP
SCHEMBL7210016 0.69 SLC6A2 (0.51) SLC6A2SLC6A4SLC6A3
SCHEMBL7209988 0.69 SLC6A2 (0.51) SLC6A2SLC6A4SLC6A3
SCHEMBL1023136 0.69 SLC6A2 (0.72) SLC6A2SLC6A4SLC6A3
Hydrochloric Acid SCHEMBL1022136 0.68 SLC6A2 (0.71) SLC6A2SLC6A4SLC6A3KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0984966-A1 9-AZABICYCLO(3.3.1)NON-2-ENE AND NONANE DERIVATIVES AS CHOLINERGIC LIGANDS AT NICOTINIC ACh RECEPTORS NEUROSEARCH A/S (DK) 2000-03-15 EP claimed
WO-1998054182-A1 9-AZABICYCLO(3.3.1)NON-2-ENE AND NONANE DERIVATIVES AS CHOLINERGIC LIGANDS AT NICOTINIC ACh RECEPTORS NEUROSEARCH A/S (DK) 1998-12-03 WO claimed
US-6392045-B1 9-azobicyclo[3.3.1] non-2-ene derivatives as cholinergic ligands at nicotinic ACH receptors NEUROSEARCH A/S (DK) 2002-05-21 US disclosed
EP-0984966-A1 9-AZABICYCLO(3.3.1)NON-2-ENE AND NONANE DERIVATIVES AS CHOLINERGIC LIGANDS AT NICOTINIC ACh RECEPTORS NEUROSEARCH A/S (DK) 2000-03-15 EP disclosed
WO-1998054182-A1 9-AZABICYCLO(3.3.1)NON-2-ENE AND NONANE DERIVATIVES AS CHOLINERGIC LIGANDS AT NICOTINIC ACh RECEPTORS NEUROSEARCH A/S (DK) 1998-12-03 WO disclosed