SCHEMBL6807528

SCHEMBL6807528

NCCCC[C@@H](NC(=O)c1cccc(C(=O)c2ccccc2)c1)C(=O)O

nearest known ligand 0.54

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LNPEP Q9UIQ6 5/20 0.54
ERAP2 Q6P179 4/20 0.54
ERAP1 Q9NZ08 2/20 0.53
HPGDS O60760 1/20 0.50
C3AR1 Q16581 1/20 0.49
ITGB3 P05106 1/20 0.49
ITGA2B P08514 1/20 0.49
MMP2 P08253 1/20 0.46
MMP9 P14780 1/20 0.46
ATM Q13315 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
PYGL P06737 1/20 0.46
PLG P00747 1/20 0.45
CTSB P07858 1/20 0.45

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
SCHEMBL22312697 0.91 ITGB3 (0.55) LNPEPERAP2ERAP1HPGDSC3AR1
SCHEMBL6810961 0.91 ITGB3 (0.55) LNPEPERAP2ERAP1HPGDSC3AR1
SCHEMBL7390292 0.91 ITGB3 (0.55) LNPEPERAP2ERAP1HPGDSC3AR1
SCHEMBL607886 0.88 ITGB3 (0.60) LNPEPERAP2ERAP1HPGDSC3AR1
SCHEMBL607885 0.88 ITGB3 (0.60) LNPEPERAP2ERAP1HPGDSC3AR1
Hydrochloric Acid SCHEMBL2331400 0.86 LNPEP (0.53) LNPEPERAP2ERAP1HPGDSC3AR1
SCHEMBL10374327 0.86 LNPEP (0.53) LNPEPERAP2ERAP1HPGDSC3AR1
SCHEMBL29504058 0.85 LNPEP (0.52) LNPEPERAP2ERAP1HPGDSC3AR1
SCHEMBL1980652 0.83 ITGB3 (0.57) LNPEPERAP2ERAP1HPGDSC3AR1
SCHEMBL1980150 0.83 ITGB3 (0.57) LNPEPERAP2ERAP1HPGDSC3AR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0692982-B1 RADIOLABELED PLATELET GPIIb/IIIa RECEPTOR ANTAGONISTS AS IMAGING AGENTS FOR THE DIAGNOSIS OF THROMBOEMBOLIC DISORDERS DU PONT PHARM CO (US) 2000-07-05 EP claimed
EP-0995761-A2 Radiolabeled platelet GPIIb/IIIa receptor antagonists as imaging agents for the diagnosis of thromboembolic disorders Dupont Pharmaceuticals Company (US) 2000-04-26 EP claimed
US-6818659-B2 TARGETS AND BINDS BIOLOGICAL RECEPTORS; MEDICAL DIAGNOSIS; MAGNETIC RESONANCE, X-RAY, ULTRASOUND, AND CONTRAST IMAGING BRISTOL-MYERS SQUIBB PHARMA, INC. 2004-11-16 US disclosed
US-20040087603-A1 (2S) -2-AMINO-4-(2-AMINO-(3,4,5,6-TETRAHYDROPYRIMIDIN-4-YL) BUTANOYL AND ITS USE IN CYCLIC AND ACYCLIC PEPTIDES LANTHEUS MEDICAL IMAGING, INC. 2004-05-06 US disclosed
EP-0692982-B1 RADIOLABELED PLATELET GPIIb/IIIa RECEPTOR ANTAGONISTS AS IMAGING AGENTS FOR THE DIAGNOSIS OF THROMBOEMBOLIC DISORDERS DU PONT PHARM CO (US) 2000-07-05 EP disclosed
EP-0995761-A2 Radiolabeled platelet GPIIb/IIIa receptor antagonists as imaging agents for the diagnosis of thromboembolic disorders Dupont Pharmaceuticals Company (US) 2000-04-26 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-20040087603-A1 (2S) -2-AMINO-4-(2-AMINO-(3,4,5,6-TETRAHYDROPYRIMIDIN-4-YL) BUTANOYL AND ITS USE IN CYCLIC AND ACYCLIC PEPTIDES VIP, ARGLU1, NGLY1 LNPEP 9/4885ERAP2 191/4885ERAP1 239/4885

“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.