Phosphoric Acid

Phosphoric Acid

SCHEMBL3012810

C=CCNCCCNCC=C.O=P(O)(O)O.O=P(O)(O)O

nearest known ligand 0.40

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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 18)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
MAPT P10636 1/20 0.37
KDM4E B2RXH2 4/20 0.36
ALDH1A1 P00352 3/20 0.36
GAA P10253 2/20 0.36
NPC1 O15118 1/20 0.36
RAB9A P51151 1/20 0.36
KMT2A Q03164 1/20 0.36
KDM1A O60341 2/20 0.34
PAOX Q6QHF9 1/20 0.34
SMOX Q9NWM0 1/20 0.33
SAT1 P21673 1/20 0.33
LMNA P02545 1/20 0.33
S1PR2 O95136 1/20 0.32
S1PR4 O95977 1/20 0.32
S1PR1 P21453 1/20 0.32
S1PR3 Q99500 1/20 0.32

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 SCHEMBL29789433 1.00 TSHR (0.37) TSHRSMN1; SMN2MAPTKDM4EALDH1A1
Phosphoric Acid SCHEMBL3014553 0.95 PAOX (0.39) TSHRSMN1; SMN2MAPTKDM4EALDH1A1
Phosphoric Acid SCHEMBL3008673 0.93 S1PR2 (0.39) TSHRSMN1; SMN2MAPTKDM4EALDH1A1
Phosphoric Acid SCHEMBL3123373 0.93 S1PR2 (0.39) TSHRSMN1; SMN2MAPTKDM4EALDH1A1
Phosphoric Acid SCHEMBL3015655 0.90 SMN1; SMN2 (0.34) TSHRSMN1; SMN2MAPTKDM4EALDH1A1
Phosphoric Acid SCHEMBL5167421 0.85 TSHR (0.37) TSHRSMN1; SMN2MAPTKDM4EALDH1A1
SCHEMBL1948513 0.84 KDM1A (0.43) TSHRSMN1; SMN2MAPTKDM4EALDH1A1
Phosphoric Acid SCHEMBL27549606 0.84 S1PR2 (0.55) TSHRALDH1A1S1PR2S1PR4S1PR1
Pyrophosphoric Acid SCHEMBL3019122 0.83 FDPS (0.40) KDM4EALDH1A1GAANPC1RAB9A
Hydrochloric Acid SCHEMBL29789467 0.82 KDM1A (0.46) TSHRSMN1; SMN2MAPTKDM4EALDH1A1

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-20100189679-A1 CROSSLINKED POLYALLYLAMINE OR ACID ADDITION SALT THEREOF, AND USE THEREOF FOR MEDICAL PURPOSES TORAY INDUSTRIES, INC. (JP) 2010-07-29 US claimed
EP-2168992-A1 CROSSLINKED POLYALLYLAMINE OR ACID ADDITION SALT THEREOF, AND USE THEREOF FOR MEDICAL PURPOSES Toray Industries, Inc. (JP) 2010-03-31 EP claimed
US-20100189679-A1 CROSSLINKED POLYALLYLAMINE OR ACID ADDITION SALT THEREOF, AND USE THEREOF FOR MEDICAL PURPOSES TORAY INDUSTRIES, INC. (JP) 2010-07-29 US disclosed
EP-2168992-A1 CROSSLINKED POLYALLYLAMINE OR ACID ADDITION SALT THEREOF, AND USE THEREOF FOR MEDICAL PURPOSES Toray Industries, Inc. (JP) 2010-03-31 EP 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 (1 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-20100189679-A1 CROSSLINKED POLYALLYLAMINE OR ACID ADDITION SALT THEREOF, AND USE THEREOF FOR MEDICAL PURPOSES SLC6A12, SLC20A1, SLC20A2 TSHR 4350/4885SMN1; SMN2 3637/4885MAPT 3359/4885

“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.