SCHEMBL2779265

SCHEMBL2779265

O=C(O)C[C@H](C(=O)O)N1CCN(CC(=O)O)CCN(CC(=O)O)CCN(CC(=O)O)CC1

nearest known ligand 0.58

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SLC6A9 P48067 1/20 0.45
HSD17B10 Q99714 2/20 0.42
ALB P02768 1/20 0.35
POLB P06746 1/20 0.35
MAPK1 P28482 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
TACR1 P25103 3/20 0.34
MAPT P10636 1/20 0.34
ALDH1A1 P00352 1/20 0.33
TP53 P04637 1/20 0.33
TDP1 Q9NUW8 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
SCHEMBL4677176 1.00 SLC6A9 (0.45) SLC6A9HSD17B10ALBPOLBMAPK1
SCHEMBL15780321 1.00 SLC6A9 (0.45) SLC6A9HSD17B10ALBPOLBMAPK1
SCHEMBL25137537 0.92 SLC6A9 (0.40) SLC6A9HSD17B10ALBPOLBMAPK1
SCHEMBL16922658 0.92 MAPT (0.44) SLC6A9HSD17B10TACR1MAPTALDH1A1
SCHEMBL17190336 0.92 MAPT (0.44) SLC6A9HSD17B10TACR1MAPTALDH1A1
SCHEMBL15444498 0.89 SLC6A9 (0.38) SLC6A9HSD17B10ALBPOLBMAPK1
SCHEMBL12768265 0.89 CHRM5 (0.40) SLC6A9HSD17B10ALBPOLBMAPK1
SCHEMBL8562008 0.88 HSD17B10 (0.43) HSD17B10POLBMAPK1L3MBTL1MAPT
SCHEMBL11713448 0.88 HSD17B10 (0.43) HSD17B10POLBMAPK1L3MBTL1MAPT
SCHEMBL17706711 0.88 HSD17B10 (0.43) HSD17B10POLBMAPK1L3MBTL1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8444954-B2 Gastrin releasing peptide compounds BRACCO IMAGING S.P.A. (IT) 2013-05-21 US disclosed
US-8420053-B2 Gastrin releasing peptide compounds BRACCO IMAGING S.P.A. (IT) 2013-04-16 US disclosed
US-8420050-B2 Gastrin releasing peptide compounds BRACCO IMAGING S.P.A. (IT) 2013-04-16 US disclosed
US-8414864-B2 Bombesin capable of complexing with metal ions, radionuclides, or optical labels; radiotherapy BRACCO IMAGING S.P.A. (IT) 2013-04-09 US disclosed
US-7850947-B2 Gastrin releasing peptide compounds BRACCO IMAGING S.P.A. (IT) 2010-12-14 US disclosed
WO-2009143101-A2 GASTRIN RELEASING PEPTIDE COMPOUNDS BRACCO IMAGING S.P.A. (IT) 2009-11-26 WO disclosed
US-7611692-B2 bombesin, derivatives and/or analogues capable of complexing metal ions, radionuclides or optical labels, for use in radiotherapy BRACCO IMAGING S.P.A. (IT) 2009-11-03 US disclosed
US-20090175786-A1 Gastrin Releasing Peptide Compounds BRACCO IMAGING S.P.A. (IT) 2009-07-09 US disclosed
EP-1706154-A4 IMPROVED GASTRIN RELEASING PEPTIDE COMPOUNDS BRACCO SPA (IT) 2008-11-26 EP disclosed
US-20080247946-A1 Bombesin capable of complexing with metal ions, radionuclides, or optical labels; radiotherapy BRACCO IMAGING S.P.A. (IT) 2008-10-09 US disclosed
US-20070231257-A1 Radiodiagnosis, radiotherapy BRACCO IMAGING S.P.A. (IT) 2007-10-04 US disclosed
US-7226577-B2 Gastrin releasing peptide compounds BRACCO IMAGING, S. P. A. (IT) 2007-06-05 US disclosed
US-20060239914-A1 Gastrin releasing peptide compounds BRACCO IMAGING S.P.A. (IT) 2006-10-26 US disclosed
US-20060241018-A1 Linkers for radiopharmaceutical compounds BRACCO IMAGING S.P.A. (IT) 2006-10-26 US disclosed
US-20060239923-A1 Gastrin releasing peptide compounds BRACCO IMAGING S.P.A. (IT) 2006-10-26 US disclosed
EP-1706154-A1 IMPROVED GASTRIN RELEASING PEPTIDE COMPOUNDS Bracco Imaging, S.P.A. (IT) 2006-10-04 EP disclosed
US-20060018830-A1 Gastrin releasing peptide compounds BRACCO IMAGING S.P.A. (IT) 2006-01-26 US disclosed
WO-2005067983-A1 IMPROVED GASTRIN RELEASING PEPTIDE COMPOUNDS BRACCO IMAGING S.P.A. (IT) 2005-07-28 WO disclosed
US-20040253225-A1 bombesin, derivatives and/or analogues capable of complexing metal ions, radionuclides or optical labels, for use in radiotherapy BRACCO IMAGING S.P.A. (IT) 2004-12-16 US disclosed
US-20040136906-A1 Gastrin releasing peptide compounds BRACCO IMAGING S.P.A. (IT) 2004-07-15 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 (9 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-20060239914-A1 Gastrin releasing peptide compounds GRPR, GIPR, CCKBR SLC6A9 1552/4885HSD17B10 4843/4885ALB 619/4885
US-20090175786-A1 Gastrin Releasing Peptide Compounds GRPR, SSTR5, GIPR SLC6A9 927/4885HSD17B10 4647/4885ALB 924/4885
US-20040253225-A1 bombesin, derivatives and/or analogues capable of complexing metal ions, radionuclides or optical labels, for use in radiotherapy GRPR, MLNR, NPBWR1 SLC6A9 2587/4885HSD17B10 4878/4885ALB 3350/4885
US-20060239923-A1 Gastrin releasing peptide compounds GRPR, GIPR, CCKBR SLC6A9 2279/4885HSD17B10 4866/4885ALB 2265/4885
US-20060018830-A1 Gastrin releasing peptide compounds GRPR, GIPR, CCKBR SLC6A9 1552/4885HSD17B10 4843/4885ALB 619/4885
US-20060241018-A1 Linkers for radiopharmaceutical compounds VIP, QPCT, NPPA SLC6A9 4458/4885HSD17B10 4852/4885ALB 1814/4885
US-20070231257-A1 Radiodiagnosis, radiotherapy GRPR, MRGPRX2, MRGPRX1 SLC6A9 1275/4885HSD17B10 4783/4885ALB 2544/4885
US-20040136906-A1 Gastrin releasing peptide compounds GRPR, GIPR, MLNR SLC6A9 2144/4885HSD17B10 4863/4885ALB 2192/4885
US-20080247946-A1 Bombesin capable of complexing with metal ions, radionuclides, or optical labels; radiotherapy GRPR, MRGPRX1, BRS3 SLC6A9 2291/4885HSD17B10 4880/4885ALB 3268/4885

“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.