Phosphoric Acid

Phosphoric Acid

SCHEMBL21489424

Nc1nc2c(ncn2[C@@H]2O[C@H](CO)[C@@H](O)[C@@]2(O)C(F)(F)F)c(=O)[nH]1.O=P(O)(O)O.O=P(O)(O)O.O=P(O)(O)O

nearest known ligand 0.49

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Known targets — ChEMBL curated mechanism

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

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

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ NT5E P21589 1/20 0.49
▸ TGM2 P21980 1/20 0.48
▸ POLB P06746 1/20 0.47
▸ ADORA3 P0DMS8 1/20 0.46
▸ KRAS P01116 2/20 0.46
▸ PNP P00491 5/20 0.46
▸ HPGD P15428 2/20 0.46
▸ ADORA2A P29274 1/20 0.45
▸ HPRT1 P00492 2/20 0.45
▸ HINT1 P49773 1/20 0.43

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
Phosphoric Acid SCHEMBL21489243 1.00 NT5E (0.49) NT5ETGM2POLBADORA3KRAS
SCHEMBL6837868 0.96 ADORA3 (0.49) NT5ETGM2POLBADORA3PNP
SCHEMBL15798398 0.96 ADORA3 (0.49) NT5ETGM2POLBADORA3PNP
Phosphoric Acid SCHEMBL21465104 0.88 NT5E (0.51) NT5ETGM2POLBADORA3PNP
2'-B-Methyl-Guanosine SCHEMBL722478 0.87 ADORA2A (0.61) NT5ETGM2POLBADORA3PNP
SCHEMBL4844756 0.84 ADORA3 (0.51) NT5EPOLBADORA3PNPHPGD
SCHEMBL546453 0.84 ADORA3 (0.51) NT5EPOLBADORA3PNPHPGD
Phosphoric Acid SCHEMBL21465266 0.84 NT5E (0.49) NT5ETGM2POLBADORA3KRAS
Phosphoric Acid SCHEMBL21465265 0.84 NT5E (0.49) NT5ETGM2POLBADORA3KRAS
SCHEMBL6537055 0.84 ADORA3 (0.53) NT5EPOLBADORA3PNPHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230242569-A1 PHOSPHOROUS (V)-BASED REAGENTS, PROCESSES FOR THE PREPARATION THEREOF, AND THEIR USE IN MAKING STEREO-DEFINED ORGANOPHOSHOROUS (V) COMPOUNDS THE SCRIPPS RESEARCH INSTITUTE 2023-08-03 — — US disclosed
US-20230212204-A1 REAGENTS AND THEIR USE FOR MODULAR ENANTIODIVERGENT SYNTHESIS OF C-P BONDS THE SCRIPPS RESEARCH INSTITUTE 2023-07-06 — — US disclosed
US-11613554-B2 Phosphorous (V)-based reagents, processes for the preparation thereof, and their use in making stereo-defined organophoshorous (V) compounds BRISTOL-MYERS SQUIBB COMPANY (US) 2023-03-28 — — US disclosed
CN-115244061-A Reagents and their use for modular enantioselective synthesis of C-P bonds 百时美施贵宝公司 2022-10-25 — — CN disclosed
CN-112236438-A Novel phosphorus (V) -based reagents, method for the production thereof, and use thereof for producing sterically defined organic phosphorus (V) compounds 百时美施贵宝公司 2021-01-15 — — CN disclosed
US-20190322694-A1 NOVEL PHOSPHOROUS (V)-BASED REAGENTS, PROCESSES FOR THE PREPARATION THEREOF, AND THEIR USE IN MAKING STEREO-DEFINED ORGANOPHOSHOROUS (V) COMPOUNDS THE SCRIPPS RESEARCH INSTITUTE 2019-10-24 — — US 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-20230242569-A1 PHOSPHOROUS (V)-BASED REAGENTS, PROCESSES FOR THE PREPARATION THEREOF, AND THEIR USE IN MAKING STEREO-DEFINED ORGANOPHOSHOROUS (V) COMPOUNDS PPIP5K2, INPP5B, PTMS NT5E 472/4885TGM2 1128/4885POLB 1692/4885
US-11613554-B2 Phosphorous (V)-based reagents, processes for the preparation thereof, and their use in making stereo-defined organophoshorous (V) compounds PPIP5K2, INPP5B, PTMS NT5E 472/4885TGM2 1128/4885POLB 1692/4885
US-20190322694-A1 NOVEL PHOSPHOROUS (V)-BASED REAGENTS, PROCESSES FOR THE PREPARATION THEREOF, AND THEIR USE IN MAKING STEREO-DEFINED ORGANOPHOSHOROUS (V) COMPOUNDS PPIP5K2, INPP5B, PTMS NT5E 379/4885TGM2 1266/4885POLB 2210/4885
US-20230212204-A1 REAGENTS AND THEIR USE FOR MODULAR ENANTIODIVERGENT SYNTHESIS OF C-P BONDS PNKP, POLL, RNGTT NT5E 242/4885TGM2 3052/4885POLB 95/4885

“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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