SCHEMBL6557274

SCHEMBL6557274

C=C([C]=O)S(=O)(=O)CCCCC

nearest known ligand 0.42

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ENPP2 Q13822 4/20 0.42
FAAH O00519 5/20 0.40
CA2 P00918 4/20 0.36
CES1 P23141 5/20 0.34
CES2 O00748 2/20 0.34

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
SCHEMBL28391254 0.82 ENPP2 (0.41) ENPP2FAAHCA2CES1CES2
SCHEMBL30554612 0.80 ENPP2 (0.44) ENPP2FAAHCA2CES1CES2
SCHEMBL10616097 0.78 ENPP2 (0.47) ENPP2FAAHCA2CES1CES2
SCHEMBL4554474 0.76 ENPP2 (0.46) ENPP2FAAHCA2CES1CES2
SCHEMBL10917863 0.70 FAAH (0.54) ENPP2FAAHCA2CES1CES2
SCHEMBL2251339 0.70 ENPP2 (0.44) ENPP2FAAHCA2CES1CES2
SCHEMBL8634688 0.70 FAAH (0.48) ENPP2FAAHCA2CES1CES2
SCHEMBL3217870 0.69 ENPP2 (0.41) ENPP2FAAHCA2CES1CES2
SCHEMBL11881585 0.69 AKR1B1 (0.50) FAAHCES1CES2
SCHEMBL4794021 0.67 CA2 (0.45) ENPP2FAAHCA2CES1CES2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1392777-A1 NOVEL REACTIVE DYES AND USE THEREOF FOR DYEING SUBSTRATES CONTAINING NUCLEOPHILIC GROUPS BASF AKTIENGESELLSCHAFT (DE) 2004-03-03 EP disclosed
WO-2002088257-A1 NOVEL REACTIVE DYES AND USE THEREOF FOR DYEING SUBSTRATES CONTAINING NUCLEOPHILIC GROUPS BASF AKTIENGESELLSCHAFT (DE) 2002-11-07 WO disclosed
EP-0876431-B1 REACTIVE AZO DYES WITH AN AMINONAPHTHALENESULFONIC ACID COUPLING COMPONENT AND INTERMEDIATES THEREFOR DYSTAR TEXTILFARBEN GMBH & CO (DE) 2001-10-31 EP disclosed
US-6011140-A Reactive azo dyes with an aminonaphthalenesulfonic acid coupling component and intermediates therefor BASF AKTIENGESELLSCHAFT (DE) 2000-01-04 US disclosed
EP-0876431-A1 REACTIVE AZO DYES WITH AN AMINONAPHTHALENESULFONIC ACID COUPLING COMPONENT AND INTERMEDIATES THEREFOR BASF AKTIENGESELLSCHAFT (DE) 1998-11-11 EP disclosed
WO-1997025377-A1 REACTIVE AZO DYES WITH AN AMINONAPHTHALENESULFONIC ACID COUPLING COMPONENT AND INTERMEDIATES THEREFOR BASF AKTIENGESELLSCHAFT (DE) 1997-07-17 WO disclosed
US-4299764-A Azo reactive dyestuffs BAYER AKTIENGESELLSCHAFT (DE) 1981-11-10 US disclosed
US-4280956-A CONTAINING SULFONAMIDE GROUPS BAYER AKTIENGESELLSCHAFT (DE) 1981-07-28 US disclosed
US-4051134-A Reactive dyestuffs BAYER AKTIENGESELLSCHAFT (DT) 1977-09-27 US disclosed