SCHEMBL598472

SCHEMBL598472

CCCC(=O)OC(=O)[C@@H](N)[C@@H](C)CC

nearest known ligand 0.50

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.50
DPP4 P27487 14/20 0.39
DPP8 Q6V1X1 8/20 0.39
DPP9 Q86TI2 7/20 0.39
DPP7 Q9UHL4 7/20 0.35
ALOX15 P16050 1/20 0.34
IARS1 P41252 1/20 0.33

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
SCHEMBL13324435 1.00 ALDH1A1 (0.50) ALDH1A1DPP4DPP8DPP9DPP7
SCHEMBL542821 0.92 DPP4 (0.41) ALDH1A1DPP4DPP8DPP9DPP7
SCHEMBL3283798 0.88 MAPT (0.47) ALDH1A1
SCHEMBL598924 0.88 MAPT (0.47) ALDH1A1
SCHEMBL6136549 0.86 DPP4 (0.42) DPP4DPP8DPP9DPP7IARS1
SCHEMBL599360 0.86 LMNA (0.50) ALDH1A1
SCHEMBL598488 0.86 LMNA (0.50) ALDH1A1
SCHEMBL598288 0.86 LMNA (0.50) ALDH1A1
SCHEMBL9664746 0.86 LMNA (0.50) ALDH1A1
SCHEMBL9665651 0.86 LMNA (0.50) ALDH1A1

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 32 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0946499-B1 N-(ARYL/HETEROARYL/ALKYLACETYL) AMINO ACID AMIDES, PHARMACEUTICAL COMPOSITIONS COMPRISING SAME, AND METHODS FOR INHIBITING BETA-AMYLOID PEPTIDE RELEASE AND/OR ITS SYNTHESIS BY USE OF SUCH COMPOUNDS ELAN PHARM INC (US) 2005-06-01 EP claimed
EP-1948199-B1 PHARMACEUTICAL COMPOSITIONS FOR THE ADMINISTRATION OF APTAMERS IDEXX LAB INC (US) 2015-08-12 EP disclosed
US-9078864-B2 Agonists for antimicrobial peptide systems AKTHELIA PHARMACEUTICALS (IS) 2015-07-14 US disclosed
EP-1960415-B1 Phospholipid gel compositions for delivery of aptamers and methods of treating conditions using same IDEXX LAB INC (US) 2015-03-04 EP disclosed
CN-101959429-B Agonists of antimicrobial peptide systems AKTHELIA PHARMACEUTICALS 2014-09-10 CN disclosed
US-8293253-B2 Compositions for controlled delivery of pharmaceutically active compounds IDEXX LABORATORIES, INC. (US) 2012-10-23 US disclosed
US-8114440-B2 Pharmaceutical compositions for the administration of aptamers IDEXX LABORATORIES INC. (US) 2012-02-14 US disclosed
US-8017159-B2 Phospholipid gel compositions for delivery of aptamers and methods of treating conditions using same IDEXX LABORATORIES, INC. (US) 2011-09-13 US disclosed
US-20110118217-A1 Agonists for Antimicrobial Peptide Systems AKTHELIA PHARMACEUTICALS (IS) 2011-05-19 US disclosed
CN-101959429-A Agonists of antimicrobial peptide systems AKTHELIA PHARMACEUTICALS 2011-01-26 CN disclosed
WO-2007058800-A2 PHOSPHOLIPID GEL COMPOSITIONS FOR DELIVERY OF APTAMERS AND METHODS OF TREATING CONDITIONS USING SAME IDEXX LABORATORIES INC. (US) 2007-05-24 WO disclosed
WO-2007058801-A1 PHARMACEUTICAL COMPOSITIONS FOR THE ADMINISTRATION OF APTAMERS IDEXX LABORATORIES INC. (US) 2007-05-24 WO disclosed
US-20070110827-A1 Pharmaceutical compositions for the administration of aptamers IDEXX LABORATORIES INC. 2007-05-17 US disclosed
US-20070110775-A1 Phospholipid gel compositions for delivery of aptamers and methods of treating conditions using same IDEXX LABORATORIES INC. 2007-05-17 US disclosed
US-20070111969-A1 Pharmaceutical compositions for the administration of aptamers IDEXX LABORATORIES INC. 2007-05-17 US disclosed
WO-2006050002-A2 COMPOSITIONS FOR CONTROLLED DELIVERY OF PHARMACEUTICALLY ACTIVE COMPOUNDS IDEXX LABORATORIES, INC. (US) 2006-05-11 WO disclosed
US-20060093632-A1 Compositions for controlled delivery of pharmaceutically active compounds IDEXX LABORATORIES, INC. 2006-05-04 US disclosed
EP-0946499-B1 N-(ARYL/HETEROARYL/ALKYLACETYL) AMINO ACID AMIDES, PHARMACEUTICAL COMPOSITIONS COMPRISING SAME, AND METHODS FOR INHIBITING BETA-AMYLOID PEPTIDE RELEASE AND/OR ITS SYNTHESIS BY USE OF SUCH COMPOUNDS ELAN PHARM INC (US) 2005-06-01 EP disclosed
US-20030109582-A1 Methods and compositions for stimulating secretions from paneth cells INNATE IMMUNITY, INC. 2003-06-12 US disclosed
US-20020131996-A1 Methods and compositions for blocking microbial adherence to eukaryotic cells ACTUA THERAPEUTICS, LLC 2002-09-19 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 (5 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-20060093632-A1 Compositions for controlled delivery of pharmaceutically active compounds LIPA, CEL, LPXN ALDH1A1 1640/4885DPP4 497/4885DPP8 608/4885
US-20110118217-A1 Agonists for Antimicrobial Peptide Systems VIP, GLP1R, MAVS ALDH1A1 3865/4885DPP4 72/4885DPP8 161/4885
US-20070111969-A1 Pharmaceutical compositions for the administration of aptamers PHOSPHO1, SGMS1, PCYT1A ALDH1A1 4408/4885DPP4 1254/4885DPP8 1104/4885
US-20070110827-A1 Pharmaceutical compositions for the administration of aptamers PHOSPHO1, SGMS1, PCYT1A ALDH1A1 4408/4885DPP4 1254/4885DPP8 1104/4885
US-20070110775-A1 Phospholipid gel compositions for delivery of aptamers and methods of treating conditions using same ANXA6, ANXA2, PLTP ALDH1A1 3745/4885DPP4 2561/4885DPP8 2098/4885

“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.