SCHEMBL543326

SCHEMBL543326

COc1ccc(C(=O)NCCCCCCCC(=O)O)c(O)c1

nearest known ligand 0.55

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
POLB P06746 3/20 0.55
APP P05067 1/20 0.53
MAPK1 P28482 3/20 0.53
SMN1; SMN2 Q16637 1/20 0.53
NPC1 O15118 2/20 0.52
RAB9A P51151 2/20 0.52
ALDH1A1 P00352 2/20 0.52
NAAA Q02083 1/20 0.50
TAS1R3 Q7RTX0 1/20 0.50
TAS1R1 Q7RTX1 1/20 0.50
EGLN2 Q96KS0 1/20 0.50
EGLN1 Q9GZT9 1/20 0.50
CYP3A4 P08684 1/20 0.49
HPGD P15428 1/20 0.49
NAMPT P43490 1/20 0.48
NR1H4 Q96RI1 1/20 0.48
KLKB1 P03952 1/20 0.48
MTNR1A P48039 1/20 0.48
MTNR1B P49286 1/20 0.48

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
SCHEMBL29886403 1.00 POLB (0.55) POLBAPPMAPK1SMN1; SMN2NPC1
SCHEMBL15390317 0.95 NPC1 (0.53) POLBAPPMAPK1NPC1RAB9A
SCHEMBL26702533 0.90 APP (0.52) APPMAPK1NPC1RAB9AALDH1A1
SCHEMBL2158647 0.90 NAAA (0.56) POLBMAPK1SMN1; SMN2NPC1RAB9A
SCHEMBL3196899 0.89 RAB9A (0.55) POLBAPPMAPK1SMN1; SMN2NPC1
SCHEMBL13593371 0.87 NAMPT (0.62) POLBMAPK1SMN1; SMN2NPC1RAB9A
SCHEMBL11214981 0.87 APP (0.67) APPMAPK1SMN1; SMN2NPC1RAB9A
SCHEMBL1543504 0.86 KLKB1 (0.55) APPMAPK1NPC1RAB9AALDH1A1
SCHEMBL11026787 0.85 MAPK1 (0.58) POLBAPPMAPK1ALDH1A1NAAA
SCHEMBL5656378 0.85 MAPK1 (0.58) POLBAPPMAPK1ALDH1A1NAAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116850132-A Formulations of active agents for oral administration 安提拉生物有限公司 2023-10-10 CN claimed
CN-116831977-A Formulations of active agents for oral administration 安提拉生物有限公司 2023-10-03 CN claimed
CN-116831978-A Formulations of active agents for oral administration 安提拉生物有限公司 2023-10-03 CN claimed
US-20190022228-A1 PHARMACEUTICAL FORMULATIONS CONTAINING MICROPARTICLES OR NANOPARTICLES OF A DELIVERY AGENT NOVO NORDISK NORTH AMERICA OPERATIONS A/S (DK) 2019-01-24 US claimed
EP-1781257-B1 PHARMACEUTICAL FORMULATIONS CONTAINING MICROPARTICLES OR NANOPARTICLES OF A DELIVERY AGENT EMISPHERE TECH INC (US) 2018-12-19 EP claimed
EP-2579868-B1 ORAL IRON DEFICIENCY THERAPY EMISPHERE TECH INC (US) 2018-03-07 EP claimed
US-20170189443-A1 COMPOSITIONS AND METHODS FOR TREATMENT OF DISEASES AND CONDITIONS EMPLOYING ORAL ADMINISTRATION OF SODIUM PENTOSAN POLYSULFATE AND OTHER PENTOSAN POLYSULFATE SALTS PLATINUM MONTAUR LIFE SCIENCES, LLC AND AS AGENT (KY) 2017-07-06 US claimed
EP-3110427-A1 COMPOSITIONS OF PENTOSAN POLYSULFATE SALTS FOR ORAL ADMINISTRATION AND METHODS OF USE Urigen Pharmaceuticals, Inc. (US) 2017-01-04 EP claimed
US-20160296599-A1 COMPOSITIONS FOR DELIVERING PEPTIDE YY AND PYY AGONISTS NOVO NORDISK NORTH AMERICA OPERATIONS A/S (DK) 2016-10-13 US claimed
US-9402864-B2 Oral iron deficiency therapy EMISPHERE TECHNOLOGIES, INC. (US) 2016-08-02 US claimed
EP-1781257-A2 PHARMACEUTICAL FORMULATIONS CONTAINING MICROPARTICLES OR NANOPARTICLES OF A DELIVERY AGENT Emisphere Technologies, Inc. (US) 2007-05-09 EP claimed
EP-1750729-A2 SOLID DOSAGE FORM OF WETTED HEPARIN Emisphere Technologies, Inc. (US) 2007-02-14 EP claimed
WO-2007011958-A2 INTRAORAL DOSAGE FORMS OF GLUCAGON EMISPHERE TECHNOLOGIES, INC. (US) 2007-01-25 WO claimed
WO-2006124047-A2 PHARMACEUTICAL FORMULATIONS CONTAINING MICROPARTICLES OR NANOPARTICLES OF A DELIVERY AGENT EMISPHERE TECHNOLOGIES, INC. (US) 2006-11-23 WO claimed
WO-2006017251-A2 COMPOSITIONS FOR DELIVERING PEPTIDE YY AND PYY AGONISTS EMISPHERE TECHNOLOGIES, INC. (US) 2006-02-16 WO claimed
WO-2005107773-A2 SOLID DOSAGE FORM OF WETTED HEPARIN EMISPHERE TECHNOLOGIES, INC. (US) 2005-11-17 WO claimed
EP-1175390-B1 DISODIUM SALTS, MONOHYDRATES, AND ETHANOL SOLVATES EMISPHERE TECH INC (US) 2005-02-02 EP claimed
US-20050009748-A1 Compositions for delivering peptide YY and PYY agonists EMISPHERE TECHNOLOGIES, INC. (US) 2005-01-13 US claimed
US-20030216593-A1 Method of preparing salicylamides NOVO NORDISK NORTH AMERICA OPERATIONS A/S (DK) 2003-11-20 US claimed
WO-2001092206-A1 METHOD OF PREPARING SALICYLAMIDES EMISPHERE TECHNOLOGIES, INC. (US) 2001-12-06 WO claimed

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-20050009748-A1 Compositions for delivering peptide YY and PYY agonists NPY1R, NPY4R, NPY2R POLB 4679/4885APP 255/4885MAPK1 3001/4885
US-20190022228-A1 PHARMACEUTICAL FORMULATIONS CONTAINING MICROPARTICLES OR NANOPARTICLES OF A DELIVERY AGENT CHMP4B, CD63, ADCYAP1R1 POLB 4671/4885APP 1050/4885MAPK1 2885/4885
US-20030216593-A1 Method of preparing salicylamides SCLY, ADSL, SIK3 POLB 1212/4885APP 3888/4885MAPK1 2978/4885
US-20160296599-A1 COMPOSITIONS FOR DELIVERING PEPTIDE YY AND PYY AGONISTS NPY1R, NPY4R, NPY2R POLB 4676/4885APP 256/4885MAPK1 2971/4885
US-20170189443-A1 COMPOSITIONS AND METHODS FOR TREATMENT OF DISEASES AND CONDITIONS EMPLOYING ORAL ADMINISTRATION OF SODIUM PENTOSAN POLYSULFATE AND OTHER PENTOSAN POLYSULFATE SALTS SI, SLC20A1, SLC20A2 POLB 2682/4885APP 3586/4885MAPK1 3137/4885

“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.