SCHEMBL7216207

SCHEMBL7216207

OC1(c2cccnc2)CC2CCCC(C1)N2Cc1ccccc1

nearest known ligand 0.69

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.69
HSD17B10 Q99714 1/20 0.69
MEN1 O00255 2/20 0.53
KMT2A Q03164 2/20 0.53
OPRM1 P35372 2/20 0.53
OPRL1 P41146 2/20 0.53
GAA P10253 1/20 0.49
NPSR1 Q6W5P4 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
LMNA P02545 1/20 0.47
CYP2C19 P33261 1/20 0.47
USP2 O75604 1/20 0.46
HTT P42858 2/20 0.45
DRD2 P14416 3/20 0.44
DRD4 P21917 3/20 0.44
DRD3 P35462 2/20 0.44

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
SCHEMBL7216204 1.00 ALDH1A1 (0.69) ALDH1A1HSD17B10MEN1KMT2AOPRM1
SCHEMBL6490794 0.95 ALDH1A1 (0.74) ALDH1A1HSD17B10MEN1KMT2AOPRM1
SCHEMBL6490798 0.95 ALDH1A1 (0.74) ALDH1A1HSD17B10MEN1KMT2AOPRM1
SCHEMBL1513400 0.81 DRD2 (0.62) ALDH1A1HSD17B10OPRM1OPRL1DRD2
SCHEMBL7211690 0.79 ALDH1A1 (0.56) ALDH1A1HSD17B10MEN1KMT2AOPRM1
SCHEMBL7211693 0.79 ALDH1A1 (0.56) ALDH1A1HSD17B10MEN1KMT2AOPRM1
SCHEMBL7222128 0.77 ALDH1A1 (0.53) ALDH1A1HSD17B10MEN1KMT2AOPRM1
SCHEMBL2590886 0.77 ALDH1A1 (0.53) ALDH1A1HSD17B10MEN1KMT2AOPRM1
SCHEMBL4811473 0.74 OPRM1 (0.54) ALDH1A1HSD17B10OPRM1OPRL1DRD2
SCHEMBL9911015 0.74 DRD2 (0.76) DRD2DRD4DRD3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0984966-B1 9-AZABICYCLO(3.3.1)NON-2-ENE AND NONANE DERIVATIVES AS CHOLINERGIC LIGANDS AT NICOTINIC ACh RECEPTORS NEUROSEARCH AS (DK) 2003-01-29 EP disclosed
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