SCHEMBL8557435

SCHEMBL8557435

C1COCC(CN2CCOCC2)N1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.42
ARG1 P05089 2/20 0.39
DPP4 P27487 1/20 0.33
USP2 O75604 1/20 0.32
KDM4E B2RXH2 3/20 0.31
KEAP1 Q14145 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
ALDH1A1 P00352 1/20 0.31
ADRA2A P08913 1/20 0.31
DRD2 P14416 1/20 0.31
ADRA2B P18089 1/20 0.31
ADRA2C P18825 1/20 0.31
DRD1 P21728 1/20 0.31
HTR2A P28223 1/20 0.31
HTR7 P34969 1/20 0.31
ADRA1A P35348 1/20 0.31
DRD3 P35462 1/20 0.31
OPRD1 P41143 1/20 0.31
HTR2B P41595 1/20 0.31
HSD17B10 Q99714 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
SCHEMBL22409346 0.89 ARG1 (0.39) GAAARG1ADRA2C
SCHEMBL8563302 0.89 ARG1 (0.39) GAAARG1ADRA2C
Hydrochloric Acid SCHEMBL8563521 0.87 ARG1 (0.38) GAAARG1ADRA2C
SCHEMBL1190922 0.77 HTR1A (0.44) GAAARG1DPP4HTR2A
SCHEMBL7032911 0.77 HTR1A (0.44) GAAARG1DPP4HTR2A
SCHEMBL1190924 0.77 HTR1A (0.44) GAAARG1DPP4HTR2A
SCHEMBL8562869 0.76 HTR1A (0.50) GAAARG1DPP4ALDH1A1ADRA2A
SCHEMBL28982691 0.76 GAA (0.38) GAADPP4USP2KDM4EKEAP1
SCHEMBL10326175 0.76 HTR1A (0.50) GAAARG1DPP4ALDH1A1ADRA2A
SCHEMBL10326397 0.76 HTR1A (0.50) GAAARG1DPP4ALDH1A1ADRA2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115784474-A High-temperature-resistant high-pressure-resistant phosphorus-free sodium-free or low-sodium scale and corrosion inhibitor for boiler and preparation method and application thereof 上海聚焓能源科技有限公司 2023-03-14 CN claimed
CN-115784474-A High-temperature-resistant high-pressure-resistant phosphorus-free sodium-free or low-sodium scale and corrosion inhibitor for boiler and preparation method and application thereof 上海聚焓能源科技有限公司 2023-03-14 CN disclosed
US-5756730-A Process for preparing analgesic compounds SANKYO COMPANY, LIMITED (JP) 1998-05-26 US disclosed
CN-1036004-C Process for preparing analgesic carboxylic acid amide derivatives SANKYO CO (JP) 1997-10-01 CN disclosed
US-5656758-A AMIDATION OF AN AMINE-CONTAINING THIOMORPHOLINE OR PIPERAZINE COMPOUND SANKYO COMPANY, LIMITED (JP) 1997-08-12 US disclosed
CN-1034731-C Process for preparing analgesic carboxylic acid amide derivatives SANKYO CO (JP) 1997-04-30 CN disclosed
US-5512567-A KAPPA-RECEPTOR AGONISTS SANKYO COMPANY, LIMITED (JP) 1996-04-30 US disclosed
US-5270327-A Piperidine derivatives SANKYO COMPANY, LIMITED (JP) 1993-12-14 US disclosed
EP-0356247-B1 ANALGESIC CARBOXYLIC ACID AMIDE DERIVATIVES Sankyo Company Limited (JP) 1993-03-17 EP disclosed
US-5021413-A Analgesic thiomorpholins their preparation, and pharmaceutical compositions containing them SANKYO COMPANY LIMITED (JP) 1991-06-04 US disclosed
EP-0356247-A1 Analgesic carboxylic acid amide derivatives Sankyo Company Limited (JP) 1990-02-28 EP disclosed