SCHEMBL5066684

SCHEMBL5066684

CCCCCC(CC)(P(=O)(O)O)P(=O)(O)O

nearest known ligand 0.79

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
GGPS1 O95749 8/20 0.79
FDPS P14324 12/20 0.59
SMPD1 P17405 5/20 0.55
LPAR1 Q92633 1/20 0.55
LPAR3 Q9UBY5 1/20 0.55

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
Phosphoric Acid SCHEMBL27558355 0.96 GGPS1 (0.80) GGPS1FDPSSMPD1LPAR1LPAR3
SCHEMBL10486919 0.88 GGPS1 (1.00) GGPS1FDPSSMPD1LPAR1LPAR3
SCHEMBL15876463 0.88 GGPS1 (1.00) GGPS1FDPSSMPD1LPAR1LPAR3
SCHEMBL8332966 0.83 GGPS1 (0.82) GGPS1FDPSSMPD1LPAR1LPAR3
SCHEMBL15438060 0.83 FDPS (0.54) GGPS1FDPSSMPD1LPAR1LPAR3
SCHEMBL7608166 0.82 GGPS1 (0.65) GGPS1FDPSSMPD1LPAR1LPAR3
SCHEMBL5140439 0.77 GGPS1 (0.65) GGPS1FDPSSMPD1LPAR1LPAR3
SCHEMBL3621873 0.77 FDPS (0.59) GGPS1FDPSSMPD1LPAR1LPAR3
SCHEMBL8718782 0.77 GGPS1 (0.50) GGPS1FDPSSMPD1LPAR1LPAR3
SCHEMBL8672279 0.76 FDPS (0.64) GGPS1FDPSSMPD1LPAR1LPAR3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7435359-B2 Corrosion inhibiting heat transfer materials HERCULES CHEMICAL COMPANY INCORPORATED (US) 2008-10-14 US claimed
WO-2006068790-A2 CORROSION INHIBITING HEAT TRANSFER MATERIALS HERCULES CHEMICAL COMPANY INCORPORATED (US) 2006-06-29 WO claimed
US-20060131544-A1 Corrosion inhibiting heat transfer materials HERCULES CHEMICAL COMPANY INCORPORATED 2006-06-22 US claimed
US-7435359-B2 Corrosion inhibiting heat transfer materials HERCULES CHEMICAL COMPANY INCORPORATED (US) 2008-10-14 US disclosed
WO-2006068790-A2 CORROSION INHIBITING HEAT TRANSFER MATERIALS HERCULES CHEMICAL COMPANY INCORPORATED (US) 2006-06-29 WO disclosed
US-20060131544-A1 Corrosion inhibiting heat transfer materials HERCULES CHEMICAL COMPANY INCORPORATED 2006-06-22 US disclosed