SCHEMBL78044

SCHEMBL78044

c1ccc(CCC2CNCCO2)cc1

nearest known ligand 0.51

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
DRD4 P21917 5/20 0.51
SLC6A2 P23975 10/20 0.49
SLC6A3 Q01959 8/20 0.49
SLC6A4 P31645 6/20 0.49
ADRB2 P07550 1/20 0.49
HTR1A P08908 1/20 0.49
HTR2A P28223 1/20 0.49
ADRA1A P35348 1/20 0.49
HTR2B P41595 1/20 0.49
ADRA2C P18825 1/20 0.49
CYP1A2 P05177 1/20 0.46
CYP3A4 P08684 1/20 0.46
CYP2D6 P10635 1/20 0.46
CYP2C9 P11712 1/20 0.46
DRD2 P14416 1/20 0.45
DRD3 P35462 1/20 0.45

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
SCHEMBL8924483 1.00 DRD4 (0.51) DRD4SLC6A2SLC6A3SLC6A4ADRB2
SCHEMBL11358847 0.90 SLC6A2 (0.47) DRD4SLC6A2SLC6A3SLC6A4ADRB2
SCHEMBL6978725 0.85 GFER (0.44) DRD4SLC6A2SLC6A3SLC6A4ADRB2
SCHEMBL21254392 0.85 DRD4 (0.52) DRD4SLC6A2SLC6A3SLC6A4CYP1A2
SCHEMBL27658505 0.85 DRD2 (0.51) DRD4SLC6A2SLC6A3SLC6A4ADRB2
SCHEMBL18689815 0.85 HRH1 (0.43) DRD4SLC6A2SLC6A3SLC6A4ADRB2
SCHEMBL27497060 0.85 SLC6A2 (0.40) DRD4SLC6A2SLC6A3SLC6A4ADRB2
SCHEMBL7497207 0.85 DRD4 (0.51) DRD4SLC6A2SLC6A3SLC6A4ADRB2
SCHEMBL1552999 0.84 SLC6A2 (0.50) SLC6A2SLC6A3SLC6A4ADRB2HTR1A
SCHEMBL659743 0.84 SLC6A2 (0.50) SLC6A2SLC6A3SLC6A4ADRB2HTR1A

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 56 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090163704-A1 Use of Acid Scavengers in Removal of Protons (Acidity) of the Reaction Mass During Chlorination of Sucrose-6-Acetate V.B. MEDICARE PRIVATE LIMITED (IN) 2009-06-25 US claimed
CN-101273050-A Use of acid scavengers in removal of protons (acidity) of the reaction mass during chlorination of sucrose-6- acetate PHARMED MEDICARE PVT LTD (IN) 2008-09-24 CN claimed
WO-2007054971-A2 USE OF ACID SCAVENGERS IN REMOVAL OF PROTONS (ACIDITY) OF THE REACTION MASS DURING CHLORINATION OF SUCROSE-6- ACETATE PHARMED MEDICARE PVT. LTD. (IN) 2007-05-18 WO claimed
US-11857746-B2 Wound cleansing apparatus in-situ SMITH & NEPHEW PLC (GB) 2024-01-02 US disclosed
EP-2311509-B2 WOUND CLEANSING APPARATUS IN-SITU SMITH & NEPHEW (GB) 2022-08-24 EP disclosed
US-20210046224-A1 WOUND CLEANSING APPARATUS IN-SITU SMITH & NEPHEW (GB) 2021-02-18 US disclosed
US-10758651-B2 Wound cleansing apparatus in-situ SMITH & NEPHEW PLC (GB) 2020-09-01 US disclosed
US-10426875-B2 Wound cleansing apparatus in-situ SMITH & NEPHEW PLC (GB) 2019-10-01 US disclosed
EP-2311509-B1 WOUND CLEANSING APPARATUS IN-SITU SMITH & NEPHEW (GB) 2019-06-12 EP disclosed
EP-3409307-A1 WOUND CLEANSING APPARATUS IN-SITU Smith & Nephew PLC (GB) 2018-12-05 EP disclosed
CN-104903320-B Nitrogen-containing heterocycle compound or its salt 富士胶片株式会社 2018-11-13 CN disclosed
CN-1874806-A Wound cleansing apparatus in-situ SMITH & NEPHEW (GB) 2006-12-06 CN disclosed
EP-1684826-A1 WOUND CLEANSING APPARATUS IN-SITU Smith & Nephew PLC (GB) 2006-08-02 EP disclosed
EP-1677855-A1 WOUND CLEANSING APPARATUS WITH SCAFFOLD Smith & Nephew PLC (GB) 2006-07-12 EP disclosed
WO-2005051461-A1 WOUND CLEANSING APPARATUS IN-SITU SMITH & NEPHEW PLC (GB) 2005-06-09 WO disclosed
WO-2005046762-A1 WOUND CLEANSING APPARATUS WITH SCAFFOLD SMITH & NEPHEW PLC (GB) 2005-05-26 WO disclosed
US-5614518-A Morpholine derivatives as dopamine receptor subtype ligands MERCK SHARP & DOHME LTD. (GB) 1997-03-25 US disclosed
EP-0730593-A1 MORPHOLINE DERIVATIVES AS DOPAMINE RECEPTOR SUBTYPE LIGANDS MERCK SHARP & DOHME LTD. (GB) 1996-09-11 EP disclosed
WO-1995014690-A1 MORPHOLINE DERIVATIVES AS DOPAMINE RECEPTOR SUBTYPE LIGANDS MERCK SHARP & DOHME LIMITED (GB) 1995-06-01 WO disclosed
US-4049808-A MENTAL STABILITY, SEDATIVES IMPERIAL CHEMICAL INDUSTRIES LIMITED (EN) 1977-09-20 US disclosed