SCHEMBL7571530

SCHEMBL7571530

COCC(C)N(CP(=O)(O)O)CP(=O)(O)O

nearest known ligand 0.35

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
FDPS P14324 2/20 0.35
ANPEP P15144 3/20 0.30
LAP3 P28838 2/20 0.30
ERAP1 Q9NZ08 1/20 0.30

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
SCHEMBL26876466 0.85 FDPS (0.37) FDPSANPEPLAP3ERAP1
SCHEMBL25991249 0.80 FDPS (0.33) FDPS
Methoxymethane SCHEMBL7571533 0.79 FDPS (0.35) FDPSANPEPLAP3ERAP1
SCHEMBL11139905 0.78 FDPS (0.41) FDPSANPEPLAP3ERAP1
SCHEMBL4380205 0.76 FDPS (0.39) FDPSANPEPLAP3ERAP1
SCHEMBL10634385 0.72 FDPS (0.37) FDPSANPEPLAP3ERAP1
SCHEMBL24267813 0.72 FDPS (0.32) FDPS
SCHEMBL11133667 0.72 FDPS (0.44) FDPSANPEPLAP3ERAP1
SCHEMBL20807153 0.71 FDPS (0.35) FDPSANPEPLAP3ERAP1
SCHEMBL5676951 0.70 FDPS (0.42) FDPSANPEPLAP3ERAP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0564232-B1 N,N-bis(phosphonomethyl)-2-amino-1-propanol derivatives for high pH scale control CALGON CORP (US) 2000-06-07 EP claimed
EP-0564232-A1 N,N-bis(phosphonomethyl)-2-amino-1-propanol derivatives for high pH scale control Calgon Corporation (US) 1993-10-06 EP claimed
EP-0950029-B1 METHOD FOR THE PREVENTION OF SCALE FORMATION BY USING AN ETHER-1,1-DIPHOSPHONATE NALCO CHEMICAL CO (US) 2002-09-11 EP disclosed
EP-0564232-B1 N,N-bis(phosphonomethyl)-2-amino-1-propanol derivatives for high pH scale control CALGON CORP (US) 2000-06-07 EP disclosed
US-5772893-A ON METAL SURFACES NALCO CHEMICAL COMPANY (US) 1998-06-30 US disclosed
US-5259974-A High dissolved solids, and high levels of calcium carbonate CALGON CORPORATION (US) 1993-11-09 US disclosed
EP-0564232-A1 N,N-bis(phosphonomethyl)-2-amino-1-propanol derivatives for high pH scale control Calgon Corporation (US) 1993-10-06 EP disclosed