SCHEMBL198086

SCHEMBL198086

CC(C(=O)O)c1cccc2c1oc1c(CCN)cccc12

nearest known ligand 0.40

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SLC11A2 P49281 1/20 0.40
HMGB1 P09429 1/20 0.38
GLA P06280 1/20 0.36
STING1 Q86WV6 1/20 0.36
ALOX5 P09917 1/20 0.36
METAP2 P50579 1/20 0.34
METAP1 P53582 1/20 0.34
CXCL8 P10145 1/20 0.34
MTNR1A P48039 8/20 0.34
MTNR1B P49286 8/20 0.34
PTGS2 P35354 3/20 0.33
PTGS1 P23219 2/20 0.33
PTGER4 P35408 1/20 0.32

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
SCHEMBL3860956 0.86 GPR35 (0.40) HMGB1ALOX5METAP2METAP1CXCL8
SCHEMBL30320123 0.77 PARP1 (0.46) SLC11A2HMGB1GLASTING1ALOX5
SCHEMBL198085 0.77 PARP1 (0.46) SLC11A2HMGB1GLASTING1ALOX5
Hydrochloric Acid SCHEMBL4433579 0.77 TAAR1 (0.43) HMGB1CXCL8PTGS2PTGS1
SCHEMBL11204325 0.75 ALOX5 (0.43) ALOX5CXCL8PTGS1
SCHEMBL28843796 0.73 KMT2A (0.41) SLC11A2HMGB1GLASTING1ALOX5
SCHEMBL2589150 0.70 SLC11A2 (0.43) SLC11A2HMGB1ALOX5
SCHEMBL24819001 0.69 ELANE (0.41) SLC11A2GLASTING1ALOX5MTNR1A
SCHEMBL13990693 0.69 PARP1 (0.51) SLC11A2GLASTING1ALOX5PTGER4
SCHEMBL3026634 0.69 PTGS2 (0.43) CXCL8PTGS2PTGS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2019011879-A1 THERAPEUTIC FOR TREATING CAPILLARY LEAK SYNDROME HENNING RAINER (CH) 2019-01-17 WO claimed
US-8088890-B2 Peptides and peptidomimetic compounds, the manufacturing thereof as well as their use for preparing a therapeutically and/or preventively active pharmaceutical composition FIBREX MEDICAL RESEARCH & DEVELOPMENT GMBH (AT) 2012-01-03 US claimed
EP-2334324-A2 BBETA (15-42) AND ITS ANALOGUES COMBINED WITH CYCLOSPORINE FOR TREATMENT OF REPERFUSION INJURY Fibrex Medical Research & Development GmbH (AT) 2011-06-22 EP claimed
EP-2328925-A1 PEPTIDES AND PEPTIDOMIMETIC COMPOUNDS, THE MANUFACTURING THEREOF AS WELL AS THEIR USE FOR PREPARING A THERAPEUTICALLY AND/OR PREVENTIVELY ACTIVE PHARMACEUTICAL COMPOSITION Fibrex Medical Research & Development GmbH (AT) 2011-06-08 EP claimed
EP-2274328-A1 PEPTIDES, PEPTIDOMIMETICS AND DERIVATIVES THEREOF, THE MANUFACTURING THEREOF AS WELL AS THEIR USE FOR PREPARING A THERAPEUTICALLY AND/OR PREVENTIVELY ACTIVE PHARMACEUTICAL COMPOSITION Fibrex Medical Research & Development GmbH (AT) 2011-01-19 EP claimed
WO-2010043444-A2 PHARMACEUTICAL PREPARATION FOR THE TREATMENT AND/OR PREVENTION OF ISCHEMIA/REPERFUSION INJURY AND THE SEQUELS THEREOF FIBREX MEDICAL RESEARCH & DEVELOPMENT GMBH (AT) 2010-04-22 WO claimed
WO-2010043972-A2 PHARMACEUTICAL COMPOSITIONS AND METHODS OF USE FOR THE PREVENTION AND TREATMENT OF HYPOXIC INJURY FIBREX MEDICAL RESEARCH & DEVELOPMENT GMBH (AT) 2010-04-22 WO claimed
WO-2010034041-A1 PEPTIDES AND PEPTIDOMIMETIC COMPOUNDS, THE MANUFACTURING THEREOF AS WELL AS THEIR USE FOR PREPARING A THERAPEUTICALLY AND/OR PREVENTIVELY ACTIVE PHARMACEUTICAL COMPOSITION FIBREX MEDICAL RESEARCH & DEVELOPMENT GMBH (AT) 2010-04-01 WO claimed
US-20100081787-A1 PEPTIDES AND PEPTIDOMIMETIC COMPOUNDS, THE MANUFACTURING THEREOF AS WELL AS THEIR USE FOR PREPARING A THERAPEUTICALLY AND/OR PREVENTIVELY ACTIVE PHARMACEUTICAL COMPOSITION FIBREX MEDICAL RESEARCH & DEVELOPMENT GMBH (AT) 2010-04-01 US claimed
WO-2009137850-A1 PEPTIDES, PEPTIDOMIMETICS AND DERIVATIVES THEREOF, THE MANUFACTURING THEREOF AS WELL AS THEIR USE FOR PREPARING A THERAPEUTICALLY AND/OR PREVENTIVELY ACTIVE PHARMACEUTICAL COMPOSITION FIBREX MEDICAL RESEARCH & DEVELOPMENT GMBH (AT) 2009-11-19 WO claimed
US-20070244041-A1 Peptide Yy Analogues REOSCIENCE A/S (DK) 2007-10-18 US claimed
EP-1718671-A2 PEPTIDE YY ANALOGUES Rheoscience A/S (DK) 2006-11-08 EP claimed
WO-2005080424-A2 PEPTIDE YY ANALOGUES RHEOSCIENCE A/S (DK) 2005-09-01 WO claimed
CN-116348128-A Bβ15-42 for treating viral endopdermatitis F4医药有限责任公司 2023-06-27 CN disclosed
CN-107129538-B Peptide conjugates of GLP-1 receptor agonists and gastrin and uses thereof 西兰制药公司 2021-07-16 CN disclosed
WO-2019011879-A1 THERAPEUTIC FOR TREATING CAPILLARY LEAK SYNDROME HENNING RAINER (CH) 2019-01-17 WO disclosed
US-6333402-B1 FOR THERAPY AND DIAGNOSIS DYAX CORP. 2001-12-25 US disclosed
US-6057287-A KUNITZ DOMAIN HAVING DISULFIDE BONDS AT CYSTINE 5-55, 14-38, 30-51 POSITIONS DYAX CORP. (US) 2000-05-02 US disclosed
US-6034211-A β-sheet nucleating peptidomimetics KELLY JEFFERY W (US) 2000-03-07 US disclosed
WO-1997046547-A1 β-SHEET NUCLEATING PEPTIDOMIMETICS THE TEXAS A & M UNIVERSITY SYSTEM (US) 1997-12-11 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 (2 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-20100081787-A1 PEPTIDES AND PEPTIDOMIMETIC COMPOUNDS, THE MANUFACTURING THEREOF AS WELL AS THEIR USE FOR PREPARING A THERAPEUTICALLY AND/OR PREVENTIVELY ACTIVE PHARMACEUTICAL COMPOSITION NGLY1, GHRHR, GHSR SLC11A2 1558/4885HMGB1 2250/4885GLA 1087/4885
US-20070244041-A1 Peptide Yy Analogues NPY1R, NPY2R, NPY4R SLC11A2 3907/4885HMGB1 2230/4885GLA 3447/4885

“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.