SCHEMBL14529652

SCHEMBL14529652

O=C1CN(C2CCC2)CC(=O)N1

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 3/20 0.41
OPRD1 P41143 2/20 0.41
OPRK1 P41145 2/20 0.41
OGFRL1 Q5TC84 1/20 0.41
TOP2A P11388 2/20 0.38
TOP2B Q02880 2/20 0.38
ALDH1A1 P00352 2/20 0.38
MAPT P10636 2/20 0.38
TDP1 Q9NUW8 1/20 0.38
LMNA P02545 2/20 0.38
MAPK1 P28482 1/20 0.37
CRBN Q96SW2 5/20 0.36
OPRL1 P41146 2/20 0.34
PTGS1 P23219 2/20 0.31
KDM4E B2RXH2 1/20 0.31
PKM P14618 1/20 0.31
HRH3 Q9Y5N1 1/20 0.31

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
SCHEMBL9846852 0.78 ALDH1A1 (0.39) OPRM1OPRD1OPRK1OGFRL1TOP2A
SCHEMBL9846845 0.78 ALDH1A1 (0.39) OPRM1OPRD1OPRK1OGFRL1TOP2A
SCHEMBL9846838 0.78 ALDH1A1 (0.39) OPRM1OPRD1OPRK1OGFRL1TOP2A
SCHEMBL4788784 0.75 TOP2A (0.41) TOP2ATOP2BALDH1A1MAPTTDP1
SCHEMBL9139881 0.75 TOP2A (0.41) TOP2ATOP2BALDH1A1MAPTTDP1
SCHEMBL4788789 0.75 TOP2A (0.41) TOP2ATOP2BALDH1A1MAPTTDP1
SCHEMBL6896207 0.74 KMT2A (0.46) OPRM1OPRD1OPRK1OGFRL1TOP2A
SCHEMBL9139167 0.70 TOP2A (0.41) TOP2ATOP2BALDH1A1MAPTTDP1
SCHEMBL9139155 0.70 TOP2A (0.41) TOP2ATOP2BALDH1A1MAPTTDP1
SCHEMBL897372 0.70 KMT2A (0.50) OPRM1OPRD1OPRK1OGFRL1TOP2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2007053415-A2 AGENTS FOR THE TREATMENT OF CARDIAC ARRHYTHMIAS NOVARTIS VACCINES AND DIAGNOSTICS INC. (US) 2007-05-10 WO disclosed