Phosphomethylphosphonic Acid Adenylate Ester

Phosphomethylphosphonic Acid Adenylate Ester

SCHEMBL2037068

Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)CP(=O)(O)O)[C@@H](O)[C@H]1O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ P2RX1 P51575 3/20 1.00
▸ P2RX3 P56373 3/20 1.00
▸ ALDH1A1 P00352 2/20 1.00
▸ ENPP1 P22413 6/20 0.86
▸ PLCG1 P19174 1/20 0.86
▸ NT5E P21589 1/20 0.86
▸ P2RY1 P47900 7/20 0.86
▸ P2RY2 P41231 3/20 0.86
▸ SRC P12931 2/20 0.86
▸ SMN1; SMN2 Q16637 2/20 0.86
▸ P2RX4 Q99571 1/20 0.86
▸ P2RX2 Q9UBL9 1/20 0.86
▸ P2RY11 Q96G91 2/20 0.84
▸ TRPM2 O94759 2/20 0.80
▸ MACROD2 A1Z1Q3 1/20 0.80
▸ SIRT6 Q8N6T7 1/20 0.80
▸ MACROD1 Q9BQ69 1/20 0.80
▸ DNPH1 O43598 1/20 0.76
▸ PRKAB2 O43741 1/20 0.76
▸ LDHA P00338 1/20 0.76

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
Phosphomethylphosphonic Acid Adenylate Ester SCHEMBL29493202 1.00 P2RX1 (1.00) P2RX1P2RX3ALDH1A1ENPP1PLCG1
Phosphomethylphosphonic Acid Adenylate Ester SCHEMBL14178282 1.00 P2RX1 (1.00) P2RX1P2RX3ALDH1A1ENPP1PLCG1
SCHEMBL16674886 0.96 P2RX1 (0.93) P2RX1P2RX3ALDH1A1ENPP1PLCG1
Phosphomethylphosphonic Acid Adenosyl Ester SCHEMBL15532186 0.93 ENPP1 (1.00) P2RX1P2RX3ALDH1A1ENPP1PLCG1
Phosphomethylphosphonic Acid Adenosyl Ester SCHEMBL21067537 0.93 ENPP1 (1.00) P2RX1P2RX3ALDH1A1ENPP1PLCG1
Phosphomethylphosphonic Acid Adenosyl Ester SCHEMBL24205127 0.93 ENPP1 (1.00) P2RX1P2RX3ALDH1A1ENPP1PLCG1
Phosphomethylphosphonic Acid Adenosyl Ester SCHEMBL4314227 0.93 ENPP1 (1.00) P2RX1P2RX3ALDH1A1ENPP1PLCG1
Phosphomethylphosphonic Acid Adenosyl Ester SCHEMBL21724956 0.93 ENPP1 (1.00) P2RX1P2RX3ALDH1A1ENPP1PLCG1
Phosphomethylphosphonic Acid Adenosyl Ester SCHEMBL16351400 0.93 ENPP1 (1.00) P2RX1P2RX3ALDH1A1ENPP1PLCG1
Phosphomethylphosphonic Acid Adenosyl Ester SCHEMBL29357429 0.93 ENPP1 (1.00) P2RX1P2RX3ALDH1A1ENPP1PLCG1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4662319-A2 PERSONALIZED CRISPR PROFILING FOR CANCER Integrate Bioscience LLC (US) 2025-12-17 — — EP disclosed
WO-2024168301-A2 PERSONALIZED CRISPR PROFILING FOR CANCER FUNCTION ONCOLOGY, INC. (US) 2024-08-15 — — WO disclosed
US-8008274-B2 P1-(2′-deoxycytidine 5′-)P4-(uridine 5′-)tetraphosphate, tetra-(alkali metal) salt, for treating sinusitis INSPIRE PHARMACEUTICALS, INC. (US) 2011-08-30 — — US disclosed
WO-2011077435-A1 COMPOSITIONS AND METHODS FOR REDUCING INTRAOCULAR PRESSURE BAR-ILAN UNIVERSITY (IL) 2011-06-30 — — WO disclosed
US-20090306010-A1 P1-(2'-DEOXYCYTIDINE 5'-)P4-(URIDINE 5'-)TETRAPHOSPHATE, TETRA-(ALKALI METAL) SALT, FOR TREATING DISORDERS MERCK SHARP & DOHME CORP. 2009-12-10 — — US disclosed
US-7531525-B2 P1-(2′-deoxycytidine 5′-)P4-(uridine 5′-)tetraphosphate, tetra-(alkali metal) salt, for treating cystic fibrosis INSPIRE PHARMACEUTICALS, INC. (US) 2009-05-12 — — US disclosed
US-20070197454-A1 P1-(2'-DEOXYCYTIDINE 5'-)P4-(URIDINE 5'-)TETRAPHOSPHATE, TETRA-(ALKALI METAL) SALT, FOR TREATING DISORDERS MERCK SHARP & DOHME LLC 2007-08-23 — — US disclosed
US-7223744-B2 Pharmaceutical formulation comprising dinucleoside polyphosphates and salts thereof INSPIRE PHARMACEUTICALS, INC. (US) 2007-05-29 — — US disclosed
US-20050085439-A1 Pharmaceutical formulation comprising dinucleoside polyphosphates and salts thereof MERCK SHARP & DOHME LLC 2005-04-21 — — US disclosed
US-6818629-B2 ADMINISTRATION OF A PHARMACEUTICAL FORMULATION COMPRISING A HYDROLYSIS-RESISTANT P2Y RECEPTOR AGONIST TO STIMULATE THE REMOVAL OF PATHOLOGICAL EXTRANEOUS FLUID FROM THE SUBRETINAL AND RETINAL SPACES; DINUCLEOSIDE POLYPHOSPHATE COMPOUND INSPIRE PHARMACEUTICALS, INC. 2004-11-16 — — US disclosed
US-20030186917-A1 Method of treating edematous retinal disorders MERCK SHARP & DOHME CORP. 2003-10-02 — — US disclosed
EP-0831855-A1 NUCLEOTIDE ANALOGUES FOR TOPICAL TREATMENT OF PROLIFERATIVE DISEASE OF THE SKIN HOSTETLER, Karl Y. (US) 1998-04-01 — — EP disclosed
US-5654286-A Nucleotides for topical treatment of psoriasis, and methods for using same HOSTETLER KARL Y (US) 1997-08-05 — — US disclosed
WO-1996040166-A1 NUCLEOTIDE ANALOGUES FOR TOPICAL TREATMENT OF PROLIFERATIVE DISEASE OF THE SKIN HOSTETLER KARL Y (US) 1996-12-19 — — 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 (4 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-20050085439-A1 Pharmaceutical formulation comprising dinucleoside polyphosphates and salts thereof P2RY1, P2RY11, P2RY6 P2RX1 13/4885P2RX3 11/4885ALDH1A1 3022/4885
US-20030186917-A1 Method of treating edematous retinal disorders P2RY1, P2RY11, P2RY2 P2RX1 13/4885P2RX3 9/4885ALDH1A1 2918/4885
US-20070197454-A1 P1-(2'-DEOXYCYTIDINE 5'-)P4-(URIDINE 5'-)TETRAPHOSPHATE, TETRA-(ALKALI METAL) SALT, FOR TREATING DISORDERS P2RY1, P2RY4, P2RY6 P2RX1 6/4885P2RX3 10/4885ALDH1A1 1656/4885
US-20090306010-A1 P1-(2'-DEOXYCYTIDINE 5'-)P4-(URIDINE 5'-)TETRAPHOSPHATE, TETRA-(ALKALI METAL) SALT, FOR TREATING DISORDERS P2RY1, P2RY4, P2RY2 P2RX1 8/4885P2RX3 9/4885ALDH1A1 1771/4885

“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.

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