SCHEMBL1246765

SCHEMBL1246765

CC(O)[C@H](N)C(=O)N[C@@H](CCCCN)C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1[C]=O

nearest known ligand 0.42

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ DPP4 P27487 4/20 0.42
▸ DPP7 Q9UHL4 4/20 0.42
▸ DPP8 Q6V1X1 3/20 0.42
▸ DPP9 Q86TI2 2/20 0.42
▸ ACE P12821 3/20 0.41
▸ NTSR2 O95665 2/20 0.41
▸ NTSR1 P30989 2/20 0.41
▸ GRB2 P62993 1/20 0.39
▸ CAPN1 P07384 4/20 0.38
▸ OPRK1 P41145 1/20 0.37
▸ FAP Q12884 1/20 0.36

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
SCHEMBL1246768 1.00 DPP4 (0.42) DPP4DPP7DPP8DPP9ACE
SCHEMBL3796746 0.92 DPP4 (0.49) DPP4DPP7DPP8DPP9ACE
SCHEMBL10782979 0.85 ACE (0.53) ACEOPRK1
SCHEMBL8760014 0.85 ACE (0.53) ACEOPRK1
SCHEMBL10783008 0.85 ACE (0.53) ACEOPRK1
SCHEMBL8760024 0.85 ACE (0.53) ACEOPRK1
SCHEMBL2182440 0.83 DPP4 (0.52) DPP4DPP7DPP8DPP9ACE
SCHEMBL31127563 0.80 OPRK1 (0.53) ACENTSR2NTSR1CAPN1OPRK1
SCHEMBL29530904 0.80 XIAP (0.48) ACENTSR2NTSR1GRB2CAPN1
SCHEMBL3055324 0.80 DPP4 (0.44) DPP4DPP7DPP8DPP9ACE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1289565-B1 COMPOUNDS FOR TARGETING ENDOTHELIAL CELLS BRACCO SUISSE SA (CH) 2015-04-22 — — EP disclosed
US-20120315220-A1 Compounds for Targeting Endothelial Cells, Compositions Containing the Same and Methods for Their Use BRACCO SUISSE S.A. (CH) 2012-12-13 — — US disclosed
US-8263739-B2 also targeting tumor cells that express vascular endothelial growth factor neuropilin-1 receptor; radiotherapy; radiopharmaceuticals; treating angiogenesis BRACCO SUISSE SA (CH) 2012-09-11 — — US disclosed
US-20110262366-A1 COMPOUNDS FOR TARGETING ENDOTHELIAL CELLS, COMPOSITIONS CONTAINING THE SAME AND METHODS FOR THEIR USE BRACCO INTERNATIONAL B.V. (NL) 2011-10-27 — — US disclosed
EP-2286843-A2 Compounds for targeting endothelial cells Bracco Suisse SA (CH) 2011-02-23 — — EP disclosed
US-7884183-B2 also targeting tumor cells that express vascular endothelial growth factor neuropilin-1 receptor; radiotherapy; radiopharmaceuticals; treating angiogenesis BRACCO SUISSE SA (CH) 2011-02-08 — — US disclosed
EP-2279757-A2 Compounds for targeting endothelial cells Bracco Suisse SA (CH) 2011-02-02 — — EP disclosed
US-7820621-B2 Compounds for targeting endothelial cells, compositions containing the same and methods for their use BRACCO INTERNATIONAL B.V. (NL) 2010-10-26 — — US disclosed
US-20060263303-A1 Compounds for Targeting Endothelial Cells, Compositions Containing the Same and Methods for Their Use BRACCO INTERNATIONAL BV (NL) 2006-11-23 — — US disclosed
US-20060258566-A1 Compounds for Targeting Endothelial Cells, Compositions Containing the Same and Methods for Their Use BRACCO INTERNATIONAL BV (NL) 2006-11-16 — — US disclosed
US-7109167-B2 Compounds for targeting endothelial cells, compositions containing the same and methods for their use BRACCO INTERNATIONAL B.V. (NL) 2006-09-19 — — US disclosed
US-20060153775-A1 Compounds for targeting endothelial cells, compositions containing the same and methods for their use BRACCO INTERNATIONAL B.V. (NL) 2006-07-13 — — US disclosed
EP-1289565-A2 COMPOUNDS FOR TARGETING ENDOTHELIAL CELLS Bracco Research USA (US) 2003-03-12 — — EP disclosed
US-20020147136-A1 Compounds for targeting endothelial cells, compositions containing the same and methods for their use BRACCO SUISSE SA (CH) 2002-10-10 — — US disclosed
WO-2001091805-A2 COMPOUNDS FOR TARGETING ENDOTHELIAL CELLS BRACCO RESEARCH USA (US) 2001-12-06 — — 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 (6 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-20060153775-A1 Compounds for targeting endothelial cells, compositions containing the same and methods for their use VCAM1, FLT1, EDNRA DPP4 2131/4885DPP7 2172/4885DPP8 2242/4885
US-20120315220-A1 Compounds for Targeting Endothelial Cells, Compositions Containing the Same and Methods for Their Use VCAM1, FLT1, EDNRA DPP4 2131/4885DPP7 2172/4885DPP8 2242/4885
US-20110262366-A1 COMPOUNDS FOR TARGETING ENDOTHELIAL CELLS, COMPOSITIONS CONTAINING THE SAME AND METHODS FOR THEIR USE VCAM1, FLT1, EDNRA DPP4 2131/4885DPP7 2172/4885DPP8 2242/4885
US-20020147136-A1 Compounds for targeting endothelial cells, compositions containing the same and methods for their use VCAM1, FLT1, EDNRA DPP4 2131/4885DPP7 2172/4885DPP8 2242/4885
US-20060263303-A1 Compounds for Targeting Endothelial Cells, Compositions Containing the Same and Methods for Their Use VCAM1, FLT1, EDNRA DPP4 2131/4885DPP7 2172/4885DPP8 2242/4885
US-20060258566-A1 Compounds for Targeting Endothelial Cells, Compositions Containing the Same and Methods for Their Use VCAM1, FLT1, EDNRA DPP4 2131/4885DPP7 2172/4885DPP8 2242/4885

“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.

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