SCHEMBL4095717

SCHEMBL4095717

CCCCCCCCCCCCCCCCCCC(CC(=O)O)(C(=O)O)P(=O)(O)O

nearest known ligand 0.53

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
FDPS P14324 11/20 0.53
SMPD1 P17405 2/20 0.53
GGPS1 O95749 7/20 0.52
LPAR1 Q92633 1/20 0.49
LPAR3 Q9UBY5 1/20 0.49

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
SCHEMBL11688737 0.93 FDPS (0.50) FDPSSMPD1GGPS1
SCHEMBL9486308 0.89 GGPS1 (0.59) FDPSSMPD1GGPS1LPAR1LPAR3
SCHEMBL4267775 0.89 GGPS1 (0.59) FDPSSMPD1GGPS1LPAR1LPAR3
SCHEMBL9487614 0.87 GGPS1 (0.57) FDPSSMPD1GGPS1LPAR1LPAR3
SCHEMBL14760426 0.87 FDPS (0.55) FDPSSMPD1GGPS1LPAR1LPAR3
SCHEMBL4267687 0.85 FDPS (0.53) FDPSSMPD1GGPS1LPAR1LPAR3
SCHEMBL8633056 0.85 FDPS (0.47) FDPSSMPD1GGPS1
SCHEMBL9067976 0.81 FDPS (0.52) FDPSSMPD1GGPS1LPAR1LPAR3
Butane SCHEMBL27837597 0.81 MEN1 (0.39) FDPSSMPD1
SCHEMBL8842627 0.80 FFAR1 (0.35) FDPS

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 3 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
US-20090214883-A1 CHROMIUM-FREE, THERMALLY CURABLE CORROSION PROTECTION COMPOSITION HENKEL AG & CO. KGAA (DE) 2009-08-27 US disclosed
US-20060173099-A1 Colored conversion layers on metal surfaces HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2006-08-03 US disclosed