SCHEMBL10901221

SCHEMBL10901221

CCCCCCCCCCCCCCCCCCc1cccc(OP(=O)([O-])[O-])c1.CCCCCCCCCCCCCCCCCCc1cccc(OP(=O)([O-])[O-])c1.CCCCCCCCCCCCCCCCCCc1cccc(OP(=O)([O-])[O-])c1.[Al+3].[Al+3]

nearest known ligand 0.60

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ PPARA Q07869 7/20 0.56
▸ PPARG P37231 5/20 0.56
▸ PLK1 P53350 1/20 0.48
▸ FUT7 Q11130 1/20 0.47
▸ GGPS1 O95749 1/20 0.46

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
SCHEMBL15638466 0.84 PLK1 (0.65) PPARAPPARGPLK1GGPS1
SCHEMBL11849637 0.84 PPARA (0.60) PPARAPPARGPLK1GGPS1
SCHEMBL10901224 0.83 PLK1 (0.63) PPARAPPARGPLK1GGPS1
SCHEMBL10901213 0.83 PLK1 (0.63) PPARAPPARGPLK1GGPS1
SCHEMBL15049836 0.82 PLK1 (0.62) PPARAPPARGPLK1GGPS1
SCHEMBL6429150 0.81 PPARA (0.56) PPARAPPARGPLK1
SCHEMBL1788069 0.80 PPARA (0.51) PPARAPPARGPLK1GGPS1
SCHEMBL30599779 0.80 PPARA (0.52) PPARAPPARGPLK1GGPS1
Zinc Ion SCHEMBL27836632 0.79 ENPP2 (0.53) FUT7
Zinc Ion SCHEMBL27854660 0.79 ENPP2 (0.53) FUT7

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-4622155-A IN SITU ALUMINUM SALT FORMATION HALLIBURTON COMPANY (US) 1986-11-11 — — US disclosed
US-4200540-A Method for fracturing subterranean formations HALLIBURTON COMPANY (US) 1980-04-29 — — US disclosed
US-4200539-A Fracturing compositions and method of preparing and using the same HALLIBURTON COMPANY (US) 1980-04-29 — — US disclosed
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