Pyrophosphoric Acid

Pyrophosphoric Acid

SCHEMBL3357549

CC(C)c1ccc(OO)cc1.CC(C)c1ccc(OO)cc1.CC(C)c1ccc(OO)cc1.CC(C)c1ccc(OO)cc1.O=P([O-])([O-])OP(=O)([O-])[O-].O=P([O-])([O-])OP(=O)([O-])[O-].O=P([O-])([O-])OP(=O)([O-])[O-].[Fe+3].[Fe+3].[Fe+3].[Fe+3]

nearest known ligand 0.38

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Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 4/20 0.38
KMT2A Q03164 2/20 0.38
MEN1 O00255 1/20 0.38
SMN1; SMN2 Q16637 2/20 0.36
NPC1 O15118 2/20 0.36
ALDH1A1 P00352 1/20 0.36
RXRA P19793 1/20 0.36
RXRB P28702 1/20 0.36
TYR P14679 1/20 0.35
PTPN5 P54829 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
HPGD P15428 1/20 0.35
XBP1 P17861 1/20 0.35
RECQL P46063 1/20 0.35
CA12 O43570 1/20 0.34
CA1 P00915 1/20 0.34
CA2 P00918 1/20 0.34
CA9 Q16790 1/20 0.34

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
Pyrophosphoric Acid SCHEMBL11359844 0.91 CA12 (0.37) RAB9AKMT2AMEN1SMN1; SMN2NPC1
SCHEMBL16628 0.81 RAB9A (0.46) RAB9AKMT2AMEN1SMN1; SMN2NPC1
SCHEMBL18614728 0.81 RAB9A (0.46) RAB9AKMT2AMEN1SMN1; SMN2NPC1
Sulfuric Acid SCHEMBL8554350 0.80 CA12 (0.43) RAB9AKMT2AMEN1SMN1; SMN2ALDH1A1
Methyl Alcohol SCHEMBL7601547 0.79 RAB9A (0.44) RAB9AKMT2AMEN1SMN1; SMN2NPC1
Formaldehyde SCHEMBL1618241 0.79 RAB9A (0.40) RAB9AKMT2AMEN1SMN1; SMN2NPC1
Bicarbonate SCHEMBL11150406 0.77 RAB9A (0.49) RAB9AKMT2AMEN1SMN1; SMN2NPC1
Acetone SCHEMBL11207944 0.77 RAB9A (0.49) RAB9AKMT2AMEN1SMN1; SMN2NPC1
Formaldehyde SCHEMBL8074512 0.77 RAB9A (0.44) RAB9AKMT2AMEN1SMN1; SMN2NPC1
Sulfuric Acid SCHEMBL7897751 0.77 CA12 (0.43) RAB9AKMT2AMEN1SMN1; SMN2ALDH1A1

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
EP-2217649-A1 ELASTOMERIC MATERIAL USEFUL FOR MAKING INCREASED MODULUS RUBBER E. I. du Pont de Nemours and Company (US) 2010-08-18 EP disclosed
WO-2009076132-A1 ELASTOMERIC MATERIAL USEFUL FOR MAKING INCREASED MODULUS RUBBER E. I. DU PONT DE NEMOURS AND COMPANY (US) 2009-06-18 WO disclosed
US-20090149576-A1 ELASTOMERIC MATERIAL USEFUL FOR MAKING INCREASED MODULUS RUBBER E. I. DU PONT DE NEMOURS AND COMPANY 2009-06-11 US disclosed
EP-0426024-B1 Process for incorporating organic fibrous fillers in elastomers DU PONT (US) 2000-04-12 EP disclosed
US-5205972-A Coagulating the mixture of aqueous slurry and latex, feeding through flow restriction which applies back pressure to dehydrating E. I. DU PONT DE NEMOURS AND COMPANY (US) 1993-04-27 US disclosed
US-5025044-A Feeding aqueous emulsion of elastomeric latex and asphalt into extruder with flow restrictor; for concurrent blending and dehydration E. I. DU PONT DE NEMOURS AND COMPANY (US) 1991-06-18 US disclosed
EP-0426025-A2 Extrusion isolation of blends of rubber and asphalt E.I. DU PONT DE NEMOURS AND COMPANY (US) 1991-05-08 EP disclosed