SCHEMBL8766577

SCHEMBL8766577

CCOP(=O)(CN(CCCc1ccccc1)c1ccc2c(c1)OCO2)OCC

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 4/20 0.46
HTR2C P28335 4/20 0.46
HTR2B P41595 4/20 0.46
ADRB1 P08588 1/20 0.46
HTR1A P08908 1/20 0.46
ADRA2A P08913 1/20 0.46
DRD2 P14416 1/20 0.46
ADRA2B P18089 1/20 0.46
ADRA2C P18825 1/20 0.46
DRD1 P21728 1/20 0.46
DRD4 P21917 1/20 0.46
SLC6A2 P23975 1/20 0.46
ADRA1D P25100 1/20 0.46
HTR1D P28221 1/20 0.46
SLC6A4 P31645 1/20 0.46
HTR7 P34969 1/20 0.46
ADRA1A P35348 1/20 0.46
HRH1 P35367 1/20 0.46
OPRM1 P35372 1/20 0.46
DRD3 P35462 1/20 0.46

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
SCHEMBL8766987 0.83 MAOA (0.47) HTR2AHTR2CHTR2BADRB1HTR1A
SCHEMBL7119208 0.73 HMGCR (0.43) HTR1AADRA2ADRD1SLC6A2SLC6A4
SCHEMBL8766155 0.72 HMGCR (0.42) KDM4EGAALMNAMEN1KMT2A
SCHEMBL8766679 0.72 FDPS (0.38) HTR1AADRA2ADRD1SLC6A2SLC6A4
SCHEMBL20710710 0.71 MAOB (0.51) MAOAMAOBMAPTALDH1A1NPC1
SCHEMBL8012576 0.70 KMT2A (0.43) MAPTALDH1A1NPC1RAB9AKDM4E
SCHEMBL29679451 0.68 TRPM8 (0.62) MAPTALDH1A1TRPM8NPC1RAB9A
SCHEMBL8766180 0.67 GABRA1 (0.39) DRD2OPRM1DRD3OPRK1MAPT
SCHEMBL8766494 0.67 HMGCR (0.44) DRD2OPRM1DRD3OPRK1MAOB
SCHEMBL6332632 0.67 TRPM8 (0.52) MAOBMAPTALDH1A1TRPM8NPC1

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-0559079-B1 Substituted aminophosphonate derivatives, process for their preparation and pharmaceutical compositions containing them SYMPHAR SA (CH) 1997-08-13 EP claimed
EP-0559079-A1 Substituted aminophosphonate derivatives, process for their preparation and pharmaceutical compositions containing them SYMPHAR S.A. (CH) 1993-09-08 EP claimed
EP-0559079-B1 Substituted aminophosphonate derivatives, process for their preparation and pharmaceutical compositions containing them SYMPHAR SA (CH) 1997-08-13 EP disclosed
EP-0559079-A1 Substituted aminophosphonate derivatives, process for their preparation and pharmaceutical compositions containing them SYMPHAR S.A. (CH) 1993-09-08 EP disclosed