SCHEMBL4112959

SCHEMBL4112959

C=CN(CC(NC(C)=O)NC(C)=O)C(C)=O

nearest known ligand 0.34

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.34
MAPT P10636 1/20 0.34
THRB P10828 1/20 0.34
ALOX15 P16050 1/20 0.34
NFKB1 P19838 1/20 0.34
PTGS2 P35354 1/20 0.34
THPO P40225 1/20 0.34
RECQL P46063 1/20 0.34
BLM P54132 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34

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
SCHEMBL10072284 0.75 ALDH1A1 (0.32)
SCHEMBL28678725 0.75 CA1 (0.37)
SCHEMBL21253999 0.72
SCHEMBL9054539 0.69 ALDH1A1 (0.38)
SCHEMBL5456824 0.69 ALDH1A1 (0.38)
SCHEMBL12248215 0.69
SCHEMBL7089937 0.69
SCHEMBL12213320 0.69
SCHEMBL10596836 0.69 KDM4E (0.35) KDM4EMAPTTHRBALOX15NFKB1
SCHEMBL18697531 0.68

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090226392-A1 Phosphate-Binding Polymers for Oral Administration GELTEX, INC. 2009-09-10 US disclosed
US-7459151-B2 Phosphate-binding polymers for oral administration GENZYME CORPORATION (US) 2008-12-02 US disclosed
US-20060171916-A1 Phosphate-binding polymers for oral administration HOLMES-FARLEY STEPHEN R 2006-08-03 US disclosed
US-7014846-B2 Phosphate-binding polymers for oral administration GENZYME CORPORATION (US) 2006-03-21 US disclosed
US-6858203-B2 Method of making phosphate-binding polymers for oral administration GENZYME CORPORATION (US) 2005-02-22 US disclosed
US-20040191212-A1 Phosphate-binding polymers for oral administration GENZYME CORPORATION (US) 2004-09-30 US disclosed
US-20030133902-A1 Method of making phosphate-binding polymers for oral administration GELTEX PHARMACEUTICALS, INC. 2003-07-17 US disclosed
US-6509013-B1 Water insoluble crosslinked allyl amine homo- or copolymer and carrier; removing phosphate from gastrointestinal tract; hyperphosphatemia GELTEX PHARMACEUTICALS, INC. 2003-01-21 US disclosed
US-5667775-A TREATMENT OF HYPERPHOSPHATEMIA, ION EXCHANGING, CATIONIC POLYMERS, REMOVAL OF PHOSPHATE FROM GASTROINTESTINAL TRACT GELTEX PHARMACEUTICALS, INC. (US) 1997-09-16 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-20090226392-A1 Phosphate-Binding Polymers for Oral Administration PHPT1, SLC34A2, ALPI KDM4E 4134/4885MAPT 1886/4885THRB 1295/4885
US-20030133902-A1 Method of making phosphate-binding polymers for oral administration SI, PHPT1, ALPI KDM4E 4252/4885MAPT 2148/4885THRB 2117/4885
US-20040191212-A1 Phosphate-binding polymers for oral administration PHPT1, SLC34A2, ALPI KDM4E 4134/4885MAPT 1886/4885THRB 1295/4885
US-20060171916-A1 Phosphate-binding polymers for oral administration PHPT1, SLC34A2, ALPI KDM4E 4134/4885MAPT 1886/4885THRB 1295/4885

“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.