SCHEMBL5059563

SCHEMBL5059563

NC(CCCCCP(=O)(O)OS)C(=O)O

nearest known ligand 0.53

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.53
KMT2A Q03164 1/20 0.53
TDP1 Q9NUW8 1/20 0.53
GSR P00390 1/20 0.48
BHMT Q93088 1/20 0.47
GLUL P15104 1/20 0.46
GRM8 O00222 1/20 0.45
GRM6 O15303 1/20 0.45
GRM7 Q14831 1/20 0.45
GRM4 Q14833 1/20 0.45
ARG1 P05089 3/20 0.44
ARG2 P78540 3/20 0.44
OTC P00480 1/20 0.44

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
SCHEMBL5058471 0.98 GSR (0.50) POLBKMT2ATDP1GSRBHMT
SCHEMBL5063483 0.93 GLUL (0.49) POLBKMT2ATDP1GSRBHMT
SCHEMBL3348058 0.87 GLUL (0.55) GLULGRM8GRM6GRM7GRM4
SCHEMBL21910853 0.83 POLB (0.53) POLBKMT2ATDP1GSRBHMT
SCHEMBL16887909 0.83 POLB (0.53) POLBKMT2ATDP1GSRBHMT
SCHEMBL5059560 0.82 POLB (0.55) POLBKMT2ATDP1GSRBHMT
SCHEMBL21747440 0.82 BHMT (0.67) POLBKMT2ATDP1GSRBHMT
SCHEMBL21747424 0.82 BHMT (0.67) POLBKMT2ATDP1GSRBHMT
Ap-7 SCHEMBL154303 0.82 BHMT (0.67) POLBKMT2ATDP1GSRBHMT
SCHEMBL21747426 0.82 BHMT (0.67) POLBKMT2ATDP1GSRBHMT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080317834-A1 Compounds and methods for modulating cerebral amyloid angiopathy NEUROCHEM (INTERNATIONAL) LIMITED (CH) 2008-12-25 US disclosed
US-20070078082-A1 Methods and compositions to treat glycosaminoglycan-associated molecular interactions NEUROCHEM (INTERNATIONAL) LIMITED (CH) 2007-04-05 US disclosed
US-20060116347-A1 Methods and compositions to treat glycosaminoglycan-associated molecular interactions KIACTA SARL (CH) 2006-06-01 US disclosed
US-6670399-B2 Contacting a blood vessel wall cell with an A beta 40 inhibitor, such that cerebral amyloid angiopathy is inhibited NEUROCHEM (INTERNATIONAL) LIMITED (CH) 2003-12-30 US disclosed
EP-1251837-A2 COMPOUNDS AND METHODS FOR MODULATING CEREBRAL AMYLOID ANGIOPATHY Neurochem, Inc. (CA) 2002-10-30 EP disclosed
WO-2001085093-A2 COMPOUNDS AND METHODS FOR MODULATING CEREBRAL AMYLOID ANGIOPATHY NEUROCHEM, INC. (US) 2001-11-15 WO disclosed
EP-1100487-A2 COMPOSITIONS FOR TREATING DISEASES ASSOCIATED WITH GLYCOSAMINOGLYCAN-ASSOCIATED MOLECULAR INTERACTIONS Neurochem, Inc. (CA) 2001-05-23 EP disclosed
WO-2000006133-A2 COMPOSITIONS FOR TREATING DISEASES ASSOCIATED WITH GLYCOSAMINOGLYCAN-ASSOCIATED MOLECULAR INTERACTIONS NEUROCHEM, INC. (CA) 2000-02-10 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 (3 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-20080317834-A1 Compounds and methods for modulating cerebral amyloid angiopathy APP, PYGB, MAPT POLB 4282/4885KMT2A 3285/4885TDP1 1633/4885
US-20060116347-A1 Methods and compositions to treat glycosaminoglycan-associated molecular interactions HPSE, CSGALNACT1, CD44 POLB 1772/4885KMT2A 4378/4885TDP1 2653/4885
US-20070078082-A1 Methods and compositions to treat glycosaminoglycan-associated molecular interactions HPSE, CD44, CSGALNACT1 POLB 1460/4885KMT2A 4400/4885TDP1 2728/4885

“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.