SCHEMBL5488013

SCHEMBL5488013

CC(C)C(N)CC(P(=O)(O)O)P(=O)(O)O

nearest known ligand 0.48

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ANPEP P15144 6/20 0.48
LAP3 P28838 4/20 0.48
ERAP1 Q9NZ08 1/20 0.48
FDPS P14324 4/20 0.41
ALDH1A1 P00352 2/20 0.40
TDP1 Q9NUW8 1/20 0.40
METAP1 P53582 2/20 0.39
ERAP2 Q6P179 1/20 0.37

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
SCHEMBL5496445 0.80 ANPEP (0.52) ANPEPLAP3ERAP1FDPSALDH1A1
SCHEMBL12269230 0.79 ANPEP (0.46) ANPEPLAP3ERAP1FDPSALDH1A1
SCHEMBL12269223 0.76 ANPEP (0.43) ANPEPLAP3ERAP1ALDH1A1TDP1
SCHEMBL11208375 0.75 LAP3 (0.52) ANPEPLAP3ERAP1ALDH1A1TDP1
SCHEMBL12570892 0.74 ANPEP (0.56) ANPEPLAP3ERAP1FDPSALDH1A1
SCHEMBL250204 0.73 FDPS (0.50) ANPEPLAP3ERAP1FDPSERAP2
SCHEMBL2786515 0.72 ANPEP (0.61) ANPEPLAP3ERAP1FDPSERAP2
SCHEMBL11333683 0.72 FDPS (0.46) ANPEPLAP3ERAP1FDPSALDH1A1
SCHEMBL9792344 0.72 FDPS (0.46) ANPEPLAP3ERAP1FDPSALDH1A1
SCHEMBL2840294 0.72 ANPEP (0.42) ANPEPLAP3ERAP1FDPSALDH1A1

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-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-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
US-5728650-A Herbicidal aza bisphosphonic acids and compositions containing the same ZENECA LIMITED (GB) 1998-03-17 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 (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 ANPEP 751/4885LAP3 1400/4885ERAP1 657/4885
US-20060116347-A1 Methods and compositions to treat glycosaminoglycan-associated molecular interactions HPSE, CSGALNACT1, CD44 ANPEP 161/4885LAP3 1256/4885ERAP1 413/4885
US-20070078082-A1 Methods and compositions to treat glycosaminoglycan-associated molecular interactions HPSE, CD44, CSGALNACT1 ANPEP 174/4885LAP3 1185/4885ERAP1 395/4885

“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.