SCHEMBL1247726

SCHEMBL1247726

CC(O)C(N)C(=O)NC(CCCCN)C(=O)N1CCCC1C(=O)NC(CCCN=C(N)N)C(=O)O

nearest known ligand 0.61

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ GRB2 P62993 1/20 0.61
▸ F2 P00734 1/20 0.59
▸ NRP1 O14786 3/20 0.54
▸ NTSR1 P30989 8/20 0.52
▸ NTSR2 O95665 6/20 0.52
▸ CAPN1 P07384 2/20 0.51
▸ APLNR P35414 1/20 0.50

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
SCHEMBL29392602 0.97 GRB2 (0.66) GRB2F2NRP1NTSR1NTSR2
SCHEMBL29362706 0.93 GRB2 (0.67) GRB2F2NRP1NTSR1NTSR2
SCHEMBL29364463 0.89 APLNR (0.55) GRB2F2NRP1NTSR1NTSR2
SCHEMBL29445609 0.88 F2 (0.57) GRB2F2NRP1NTSR1NTSR2
SCHEMBL194515 0.86 OPRM1 (0.48) GRB2F2NRP1NTSR1NTSR2
SCHEMBL21043608 0.86 OPRM1 (0.48) GRB2F2NRP1NTSR1NTSR2
SCHEMBL1247795 0.86 OPRM1 (0.48) GRB2F2NRP1NTSR1NTSR2
SCHEMBL1247799 0.86 OPRM1 (0.48) GRB2F2NRP1NTSR1NTSR2
SCHEMBL7263725 0.86 OPRM1 (0.48) GRB2F2NRP1NTSR1NTSR2
SCHEMBL12899263 0.86 OPRM1 (0.48) GRB2F2NRP1NTSR1NTSR2

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 16 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
WO-2007090022-A2 NOVEL COMPOUNDS FOR TARGETING ENDOTHELIAL CELLS, COMPOSITIONS CONTAINING THE SAME AND METHODS FOR THEIR USE BRACCO INTERNATIONAL B.V. (NL) 2007-08-09 — — WO 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 GRB2 756/4885F2 3814/4885NRP1 16/4885
US-20120315220-A1 Compounds for Targeting Endothelial Cells, Compositions Containing the Same and Methods for Their Use VCAM1, FLT1, EDNRA GRB2 756/4885F2 3814/4885NRP1 16/4885
US-20110262366-A1 COMPOUNDS FOR TARGETING ENDOTHELIAL CELLS, COMPOSITIONS CONTAINING THE SAME AND METHODS FOR THEIR USE VCAM1, FLT1, EDNRA GRB2 756/4885F2 3814/4885NRP1 16/4885
US-20020147136-A1 Compounds for targeting endothelial cells, compositions containing the same and methods for their use VCAM1, FLT1, EDNRA GRB2 756/4885F2 3814/4885NRP1 16/4885
US-20060263303-A1 Compounds for Targeting Endothelial Cells, Compositions Containing the Same and Methods for Their Use VCAM1, FLT1, EDNRA GRB2 756/4885F2 3814/4885NRP1 16/4885
US-20060258566-A1 Compounds for Targeting Endothelial Cells, Compositions Containing the Same and Methods for Their Use VCAM1, FLT1, EDNRA GRB2 756/4885F2 3814/4885NRP1 16/4885

“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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