SCHEMBL4093885

SCHEMBL4093885

NC(Cc1ccccc1)(P(=O)(O)O)P(=O)(O)O

nearest known ligand 0.62

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
FDPS P14324 2/20 0.62
SMN1; SMN2 Q16637 1/20 0.53
HIF1A Q16665 1/20 0.53
SLC6A2 P23975 1/20 0.48
TAAR1 Q96RJ0 1/20 0.48
LAP3 P28838 3/20 0.46
ANPEP P15144 1/20 0.46
GGPS1 O95749 2/20 0.45
PTPN1 P18031 2/20 0.44
TSHR P16473 1/20 0.44
POLB P06746 1/20 0.43

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
SCHEMBL743234 0.83 FDPS (0.66) FDPSSMN1; SMN2HIF1AANPEPTSHR
SCHEMBL4317428 0.80 FDPS (0.58) FDPSSMN1; SMN2HIF1ASLC6A2TAAR1
SCHEMBL1243460 0.80 FDPS (0.53) FDPSSMN1; SMN2HIF1ASLC6A2TAAR1
SCHEMBL7264380 0.78 FDPS (0.67) FDPSSMN1; SMN2HIF1ALAP3ANPEP
SCHEMBL3075655 0.78 FDPS (0.67) FDPSSMN1; SMN2HIF1ALAP3ANPEP
SCHEMBL7606373 0.77 FDPS (0.70) FDPSSMN1; SMN2HIF1AANPEPGGPS1
SCHEMBL3846830 0.77 FDPS (1.00) FDPSGGPS1
Phosphoric Acid SCHEMBL5459504 0.76 FDPS (0.58) FDPSSMN1; SMN2HIF1ASLC6A2TAAR1
Oxalic Acid SCHEMBL1243123 0.76 SMN1; SMN2 (0.50) FDPSSMN1; SMN2HIF1ASLC6A2TAAR1
SCHEMBL9051470 0.75 FDPS (0.62) FDPSSMN1; SMN2HIF1ALAP3ANPEP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8293029-B2 Colored conversion layers on metal surfaces HENKEL AG & CO. KGAA (DE) 2012-10-23 US disclosed
EP-2057303-B1 CHROMIUM-FREE, THERMALLY CURABLE CORROSION PROTECTION COMPOSITION HENKEL AG & CO KGAA (DE) 2012-05-23 EP disclosed
US-20090214883-A1 CHROMIUM-FREE, THERMALLY CURABLE CORROSION PROTECTION COMPOSITION HENKEL AG & CO. KGAA (DE) 2009-08-27 US disclosed
EP-1658392-B1 COLOUR CONVERSION LAYERS ON METAL SURFACES HENKEL KGAA (DE) 2007-03-14 EP disclosed
US-20060173099-A1 Colored conversion layers on metal surfaces HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2006-08-03 US disclosed
EP-1658392-A1 COLOUR CONVERSION LAYERS ON METAL SURFACES Henkel Kommanditgesellschaft auf Aktien (DE) 2006-05-24 EP disclosed
WO-2005021834-A1 COLOUR CONVERSION LAYERS ON METAL SURFACES HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2005-03-10 WO disclosed
US-5645756-A CONTAINING WATER SOLUBLE POLYMERS AND PHOSPHONATES NALCO FUEL TECH (US) 1997-07-08 US disclosed
EP-0606315-A4 HARDNESS SUPPRESSION IN UREA SOLUTIONS. NALCO FUEL TECH (US) 1994-10-19 EP disclosed
EP-0606315-A1 HARDNESS SUPPRESSION IN UREA SOLUTIONS NALCO FUEL TECH (US) 1994-07-20 EP disclosed
WO-1994002410-A1 BOILER OPERATION WITH DECREASED NOx AND WASTE WATER DISCHARGE NALCO FUEL TECH (US) 1994-02-03 WO disclosed
WO-1993007087-A1 HARDNESS SUPPRESSION IN UREA SOLUTIONS NALCO FUEL TECH (US) 1993-04-15 WO disclosed
US-5053161-A Mixture of water soluble polyacrylic acid, polymaleic acid, 1-hydroxy ethylenee, diphosphonic acid and ethylene-diamine tetr acetic acid, tetrasodium salt, corrosion resistance THE MOGUL CORPORATION (US) 1991-10-01 US disclosed
US-4978456-A ADDING MIXTURE OF WATER-SOLUBLE POLYMERS OF ACRYLIC ACID, MALEIC ACID, MALEIC ANHYDRIDE, SALT OF 1-HYDROXYETHYLIDENE-1,1-DIPHOSPHONIC ACID AND CHELATING COMPOUND THE MOGUL CORPORATION (US) 1990-12-18 US disclosed
US-4100167-A Production of 1-aminoalkane-1, 1-diphosphonic acids using phosphorous acid and nitriles in a non-aqueous system NALCO CHEMICAL COMPANY (US) 1978-07-11 US disclosed
US-3935125-A AMINE PYROPHOSPHATE, ORGANO-PHOSPHONATE, TRIAZOLE CHEMED CORPORATION (US) 1976-01-27 US disclosed