Pyrophosphoric Acid

Pyrophosphoric Acid

SCHEMBL1333304

CCCN(CCC)CCC.CCCN(CCC)CCC.CCCN(CCC)CCC.O=P(O)(O)OP(=O)(O)O

nearest known ligand 0.50

Full drug profile on Sugi Atlas →

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
FDPS P14324 3/20 0.50
BLM P54132 1/20 0.50
TDP1 Q9NUW8 1/20 0.50
LPAR3 Q9UBY5 3/20 0.37
LPAR1 Q92633 2/20 0.37
LPAR2 Q9HBW0 2/20 0.37
CA12 O43570 1/20 0.36
CA2 P00918 1/20 0.36
CA9 Q16790 1/20 0.36
MMP1 P03956 1/20 0.35
MMP2 P08253 1/20 0.35
MMP3 P08254 1/20 0.35
MMP8 P22894 1/20 0.35
MVD P53602 1/20 0.35
SMPD1 P17405 3/20 0.33
PPARD Q03181 1/20 0.33
BTN3A1 O00481 1/20 0.33

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 SCHEMBL28481504 1.00 FDPS (0.50) FDPSBLMTDP1LPAR3LPAR1
SCHEMBL28788113 0.89 MVD (0.40) FDPSBLMTDP1LPAR3LPAR1
Pyrophosphoric Acid SCHEMBL73401 0.86 MMP1 (0.47) FDPSBLMTDP1LPAR3LPAR1
Pyrophosphoric Acid SCHEMBL73402 0.86 MMP1 (0.47) FDPSBLMTDP1LPAR3LPAR1
Pyrophosphoric Acid SCHEMBL490709 0.86 MMP1 (0.47) FDPSBLMTDP1LPAR3LPAR1
Pyrophosphoric Acid SCHEMBL288516 0.86 MMP1 (0.47) FDPSBLMTDP1LPAR3LPAR1
Pyrophosphoric Acid SCHEMBL28344128 0.84 LPAR3 (0.47) FDPSBLMTDP1LPAR3LPAR1
Phosphoric Acid SCHEMBL2683526 0.84 FDPS (0.50) FDPSLPAR3LPAR2CA12CA2
Phosphoric Acid SCHEMBL5874368 0.84 FDPS (0.50) FDPSLPAR3LPAR2CA12CA2
Pyrophosphoric Acid SCHEMBL9547118 0.82 LPAR3 (0.50) FDPSBLMTDP1LPAR3LPAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9035041-B2 Process for triphosphate oligonucleotide synthesis ALNYLAM PHARMACEUTICALS, INC. (US) 2015-05-19 US disclosed
US-20120220761-A1 PROCESS FOR TRIPHOSPHATE OLIGONUCLEOTIDE SYNTHESIS ALNYLAM PHARMACEUTICALS, INC. (US) 2012-08-30 US disclosed
US-20110282044-A1 PROCESS FOR SYNTHESIZING OLIGONUCLEOTIDE PHOSPHATE DERIVATIVES ALNYLAM PHARMACEUTICALS (US) 2011-11-17 US disclosed
WO-2011028218-A1 PROCESS FOR TRIPHOSPHATE OLIGONUCLEOTIDE SYNTHESIS ALNYLAM PHARMACEUTICALS, INC. (US) 2011-03-10 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20120220761-A1 PROCESS FOR TRIPHOSPHATE OLIGONUCLEOTIDE SYNTHESIS DUT, DTYMK, ITPA FDPS 43/4885BLM 1145/4885TDP1 337/4885
US-20110282044-A1 PROCESS FOR SYNTHESIZING OLIGONUCLEOTIDE PHOSPHATE DERIVATIVES PPA1, TYMP, DCTPP1 FDPS 44/4885BLM 1471/4885TDP1 424/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.