SCHEMBL1643232

SCHEMBL1643232

O=C(CCC(=O)OP(=O)(O)O)OP(=O)(O)O.[CaH2].[CaH2].[CaH2].[CaH2].[CaH2].[CaH2].[CaH2].[CaH2].[CaH2].[CaH2].[CaH2].[CaH2].[CaH2].[CaH2].[CaH2].[CaH2]

nearest known ligand 0.46

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CA4 P22748 1/20 0.46
PEPD P12955 1/20 0.40
TSHR P16473 1/20 0.36
FDPS P14324 1/20 0.35
BLM P54132 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
TPI1 P60174 1/20 0.32
PGK1 P00558 1/20 0.31
PGK2 P07205 1/20 0.31

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
SCHEMBL285627 0.97 CA4 (0.48) CA4PEPDTSHRFDPSBLM
SCHEMBL27473070 0.94 CA4 (0.46) CA4PEPDTSHRFDPSBLM
SCHEMBL28316038 0.90 LMNA (0.43) CA4PEPDTSHRBLMTDP1
SCHEMBL8561065 0.87 LMNA (0.45) CA4PEPDTSHRBLMTDP1
Phosphonic Acid SCHEMBL7991199 0.87 CA4 (0.40) CA4PEPDTSHRFDPSBLM
SCHEMBL2201756 0.86 TSHR (0.43) CA4PEPDTSHRFDPSBLM
SCHEMBL1685045 0.85 ALDH1A1 (0.48) CA4PEPDTSHR
Ammonia Solution, Strong SCHEMBL1408904 0.83 CA4 (0.42) CA4PEPDTSHR
SCHEMBL28732280 0.83 CA4 (0.42) CA4PEPDFDPSBLMTDP1
SCHEMBL27725186 0.83 CA4 (0.42) CA4PEPDTSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110098347-A1 PHOSPHOROUS BINDER FOR TREATMENT OF KIDNEY DISEASE BIOLINK LIFE SCIENCES, INC. (US) 2011-04-28 US disclosed
US-7862836-B2 Phosphorus binder for treatment of kidney disease BIOLINK LIFE SCIENCES, INC. (US) 2011-01-04 US disclosed
US-20060228424-A1 Phosphorus binder for treatment of kidney disease BIOLINK LIFE SCIENCES, INC. 2006-10-12 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 (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-20060228424-A1 Phosphorus binder for treatment of kidney disease ALPI, PHPT1, ATP6V1B1 CA4 435/4885PEPD 274/4885TSHR 3535/4885
US-20110098347-A1 PHOSPHOROUS BINDER FOR TREATMENT OF KIDNEY DISEASE ALPI, PHPT1, FABP2 CA4 430/4885PEPD 218/4885TSHR 3444/4885

“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.