SCHEMBL4099176

SCHEMBL4099176

CCCCCCCCCCCCNCCC(O)(P(=O)(O)O)P(=O)(O)O

nearest known ligand 0.67

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
FDPS P14324 15/20 0.67
GGPS1 O95749 7/20 0.67
S1PR2 O95136 5/20 0.58
S1PR4 O95977 5/20 0.58
S1PR1 P21453 5/20 0.58
S1PR3 Q99500 5/20 0.58
S1PR5 Q9H228 1/20 0.58
AGTR1 P30556 1/20 0.51
OPRM1 P35372 1/20 0.51
PDE3A Q14432 1/20 0.51

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
SCHEMBL28434632 0.98 FDPS (0.66) FDPSGGPS1S1PR2S1PR4S1PR1
SCHEMBL11519128 0.85 FDPS (0.61) FDPSGGPS1AGTR1OPRM1PDE3A
SCHEMBL24138222 0.81 FDPS (0.62) FDPSGGPS1S1PR2S1PR4S1PR1
SCHEMBL3983089 0.81 FDPS (0.68) FDPSGGPS1S1PR2S1PR4S1PR1
SCHEMBL9489000 0.81 FDPS (1.00) FDPSGGPS1AGTR1OPRM1PDE3A
SCHEMBL4098579 0.81 FDPS (1.00) FDPSGGPS1AGTR1OPRM1PDE3A
SCHEMBL10863055 0.81 FDPS (1.00) FDPSGGPS1AGTR1OPRM1PDE3A
SCHEMBL12821754 0.81 FDPS (1.00) FDPSGGPS1AGTR1OPRM1PDE3A
SCHEMBL10686529 0.81 FDPS (1.00) FDPSGGPS1AGTR1OPRM1PDE3A
SCHEMBL10862336 0.81 FDPS (1.00) FDPSGGPS1AGTR1OPRM1PDE3A

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
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