Pyrophosphoric Acid

Pyrophosphoric Acid

SCHEMBL2325329

O=P(O)(O)O.O=P(O)(O)O.O=P(O)(O)OP(=O)(O)O

nearest known ligand 0.91

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Known targets — ChEMBL curated mechanism

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

The experimentally established mechanism targets of Pyrophosphoric Acid. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
FDPS P14324 1/20 0.91
BLM P54132 1/20 0.91
TDP1 Q9NUW8 1/20 0.91
CA4 P22748 1/20 0.37
CA2 P00918 1/20 0.36
INPPL1 O15357 2/20 0.35
INPP5A Q14642 2/20 0.35
SMPD1 P17405 1/20 0.35
INPP5B P32019 1/20 0.35
BTN3A1 O00481 2/20 0.35
ITPR3 Q14573 3/20 0.33
SLC34A1 Q06495 1/20 0.33
ITPR2 Q14571 1/20 0.33
ITPR1 Q14643 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 SCHEMBL145674 1.00 FDPS (0.91) FDPSBLMTDP1CA4CA2
Pyrophosphoric Acid SCHEMBL17765467 1.00 FDPS (0.91) FDPSBLMTDP1CA4CA2
Pyrophosphoric Acid SCHEMBL1985595 1.00 FDPS (0.91) FDPSBLMTDP1CA4CA2
Pyrophosphoric Acid SCHEMBL9522730 1.00 FDPS (0.91) FDPSBLMTDP1CA4CA2
Pyrophosphoric Acid SCHEMBL4346392 1.00 FDPS (0.91) FDPSBLMTDP1CA4CA2
Pyrophosphoric Acid SCHEMBL28049291 1.00 FDPS (0.91) FDPSBLMTDP1CA4CA2
Pyrophosphoric Acid SCHEMBL933099 1.00 FDPS (0.91) FDPSBLMTDP1CA4CA2
Pyrophosphoric Acid SCHEMBL3788496 1.00 FDPS (0.91) FDPSBLMTDP1CA4CA2
Pyrophosphoric Acid SCHEMBL23410734 0.96 FDPS (0.83) FDPSBLMTDP1CA4CA2
Pyrophosphoric Acid SCHEMBL11522910 0.96 FDPS (0.83) FDPSBLMTDP1CA4CA2

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 27 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11987583-B2 Fused triazolo-pyrimidine compounds having useful pharmaceutical application PIKSCI INC. (CA) 2024-05-21 US disclosed
US-20220402866-A1 3,4-DISUBSTITUTED 3-CYCLOBUTENE-1,2-DIONES AND USE THEREOF ALLERGAN, INC. 2022-12-22 US disclosed
US-11208377-B2 3,4-disubstituted 3-cyclobutene-1,2-diones and use thereof ALLERGAN, INC. (US) 2021-12-28 US disclosed
US-20210323969-A1 FUSED TRIAZOLO-PYRIMIDINE COMPOUNDS HAVING USEFUL PHARMACEUTICAL APPLICATION PIKSCI INC. (CA) 2021-10-21 US disclosed
US-11066410-B2 Fused triazolo-pyrimidine compounds having useful pharmaceutical application 3100 CENTRAL EXPRESSWAY LLC (US) 2021-07-20 US disclosed
EP-3700905-A1 ENAMINES AND DIASTEREO-SELECTIVE REDUCTION OF ENAMINES Allergan, Inc. (US) 2020-09-02 EP disclosed
EP-3668832-A1 3,4-DISUBSTITUTED 3-CYCLOBUTENE-1,2-DIONES AND USE THEREOF Allergan, Inc. (US) 2020-06-24 EP disclosed
US-20200079780-A1 FUSED TRIAZOLO-PYRIMIDINE COMPOUNDS HAVING USEFUL PHARMACEUTICAL APPLICATION NANOSYN, INC. 2020-03-12 US disclosed
EP-3600328-A1 FUSED TRIAZOLO-PYRIMIDINE COMPOUNDS HAVING USEFUL PHARMACEUTICAL APPLICATION Nanosyn, Inc. (US) 2020-02-05 EP disclosed
US-10501483-B2 Enamines and diastereo-selective reduction of enamines ALLERGAN, INC. (US) 2019-12-10 US disclosed
US-20150284400-A1 CANNABINOID-2 AGONISTS ALLERGAN, INC. 2015-10-08 US disclosed
EP-2534137-B1 PYRIDAZINE DERIVATIVES USEFUL AS CANNABINOID-2 AGONISTS ALLERGAN INC (US) 2015-09-16 EP disclosed
US-9062004-B2 Cannabinoid-2 agonists ALLERGAN, INC. (US) 2015-06-23 US disclosed
US-20130059848-A1 CANNABINOID-2 AGONISTS ALLERGAN, INC (US) 2013-03-07 US disclosed
EP-2534137-A1 PYRIDAZINE DERIVATIVES USEFUL AS CANNABINOID - 2 AGONISTS Allergan, Inc. (US) 2012-12-19 EP disclosed
WO-2011097553-A1 PYRIDAZINE DERIVATIVES USEFUL AS CANNABINOID - 2 AGONISTS ALLERGAN, INC. (US) 2011-08-11 WO disclosed
US-5338770-A Anticoagulants; amine-functional siloxanes reacted with polyethers coupled to bioactive material; oxygenators CARDIOPULMONICS, INC. (US) 1994-08-16 US disclosed
EP-0531305-A4 GAS PERMEABLE THROMBO-RESISTANT COATINGS AND METHODS OF MANUFACTURE 1993-03-24 EP disclosed
EP-0531305-A1 GAS PERMEABLE THROMBO-RESISTANT COATINGS AND METHODS OF MANUFACTURE CARDIOPULMONICS, INC. (US) 1993-03-17 EP disclosed
WO-1991015952-A1 GAS PERMEABLE THROMBO-RESISTANT COATINGS AND METHODS OF MANUFACTURE CARDIOPULMONICS, INC. (US) 1991-10-31 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 (9 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-20150284400-A1 CANNABINOID-2 AGONISTS CNR2, CNR1, GPR18 FDPS 1979/4885BLM 4471/4885TDP1 4436/4885
US-11987583-B2 Fused triazolo-pyrimidine compounds having useful pharmaceutical application PIKFYVE, PIP4K2B, PIP4K2A FDPS 1209/4885BLM 950/4885TDP1 340/4885
US-20210323969-A1 FUSED TRIAZOLO-PYRIMIDINE COMPOUNDS HAVING USEFUL PHARMACEUTICAL APPLICATION PIKFYVE, PIP4K2B, PIP4K2A FDPS 1209/4885BLM 950/4885TDP1 340/4885
US-20130059848-A1 CANNABINOID-2 AGONISTS CNR2, CNR1, GPR18 FDPS 2132/4885BLM 4463/4885TDP1 4505/4885
US-10501483-B2 Enamines and diastereo-selective reduction of enamines ENY2, PNMT, CHRM1 FDPS 4361/4885BLM 629/4885TDP1 3833/4885
US-11208377-B2 3,4-disubstituted 3-cyclobutene-1,2-diones and use thereof IL17A, TSLP, SSB FDPS 167/4885BLM 3463/4885TDP1 2788/4885
US-11066410-B2 Fused triazolo-pyrimidine compounds having useful pharmaceutical application PIKFYVE, PIP4K2B, PIP4K2A FDPS 1209/4885BLM 950/4885TDP1 340/4885
US-20200079780-A1 FUSED TRIAZOLO-PYRIMIDINE COMPOUNDS HAVING USEFUL PHARMACEUTICAL APPLICATION PIKFYVE, PIP4K2B, PIP4K2A FDPS 1209/4885BLM 950/4885TDP1 340/4885
US-20220402866-A1 3,4-DISUBSTITUTED 3-CYCLOBUTENE-1,2-DIONES AND USE THEREOF IL17A, TSLP, SSB FDPS 167/4885BLM 3463/4885TDP1 2788/4885

“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.