SCHEMBL3266803

SCHEMBL3266803

CCS(=O)(=O)NC(Cc1ccc(OCC2CN(c3ccc(C(=N)N)cc3)C(=O)O2)cc1)C(=O)O

nearest known ligand 0.52

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
GRM2 Q14416 9/20 0.52
ITGB3 P05106 11/20 0.47
ITGA2B P08514 11/20 0.47
PRSS1 P07477 9/20 0.47
PRSS2 P07478 9/20 0.47
PRSS3 P35030 9/20 0.47
F10 P00742 6/20 0.47
F2 P00734 1/20 0.46

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
SCHEMBL3267949 0.94 ITGB3 (0.51) GRM2ITGB3ITGA2BPRSS1PRSS2
SCHEMBL3267022 0.93 ITGB3 (0.57) GRM2ITGB3ITGA2BPRSS1PRSS2
SCHEMBL7238070 0.92 ITGB3 (0.54) GRM2ITGB3ITGA2BPRSS1PRSS2
SCHEMBL7229618 0.92 GRM2 (0.50) GRM2ITGB3ITGA2BPRSS1PRSS2
SCHEMBL6031936 0.92 ITGB3 (0.46) GRM2ITGB3ITGA2BPRSS1PRSS2
SCHEMBL7229085 0.92 ITGB3 (0.54) GRM2ITGB3ITGA2BPRSS1PRSS2
SCHEMBL7228211 0.92 ITGB3 (0.54) GRM2ITGB3ITGA2BPRSS1PRSS2
SCHEMBL7239380 0.90 GRM2 (0.53) GRM2ITGB3ITGA2BPRSS1PRSS2
SCHEMBL7239295 0.89 GRM2 (0.52) GRM2ITGB3ITGA2BPRSS1PRSS2
SCHEMBL7227714 0.89 GRM2 (0.51) GRM2ITGB3ITGA2BPRSS1PRSS2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0951295-B1 COMPOSITIONS FOR USE IN INHIBITING OF ALPHA-V-BETA3 MEDIATED ANGIOGENESIS SCRIPPS RESEARCH INST (US) 2010-06-09 EP disclosed
US-20060270710-A1 Methods for inhibition of angiogenesis THE SCRIPPS RESEARCH INSTITUTE 2006-11-30 US disclosed
US-20060165703-A1 Methods and compositions useful for inhibition of alpha v beta 5 mediated angiogenesis THE SCRIPPS RESEARCH INSTITUTE (US) 2006-07-27 US disclosed
US-7053041-B1 Methods and compositions useful for inhibition of αvβ5mediated angiogenesis THE SCRIPPS RESEARCH INSTITUTE (US) 2006-05-30 US disclosed
EP-1613268-A2 METHODS FOR INHIBITION OF ANGIOGENESIS The Scripps Research Institute (US) 2006-01-11 EP disclosed
WO-2004087057-A2 METHODS FOR INHIBITION OF ANGIOGENESIS THE SCRIPPS RESEARCH INSTITUTE (US) 2004-10-14 WO disclosed
US-20040063790-A1 Methods for inhibition of angiogenesis THE SCRIPPS RESEARCH INSTITUTE 2004-04-01 US disclosed
US-20030176334-A1 Methods and compositions useful for inhibition of angiogenesis THE SCRIPPS RESEARCH INSTITUTE (US) 2003-09-18 US disclosed
US-6602876-B1 Adhesion receptor antagonists MERCK PATENT GMBH (DE) 2003-08-05 US disclosed
US-6500924-B1 PACKAGE FOR USING ANTAGONISTS OF THE VITRONECTIN RECEPTOR ALPHA-V BETA3 COMPRISING A METALLOPROTEINASE POLYPEPTIDE OF GIVEN AMINO ACID SEQUENCE; TREATING ARTHRITIS, RHEUMATOID ARTHRITIS, RETINOPATHY AND TUMORS THE SCRIPPS RESEARCH INSTITUTE 2002-12-31 US disclosed
EP-0951295-A1 METHODS AND COMPOSITIONS USEFUL FOR INHIBITION OF ANGIOGENESIS The Scripps Research Institute (US) 1999-10-27 EP disclosed
EP-0907661-A1 METHODS AND COMPOSITIONS USEFUL FOR INHIBITION OF alpha v beta 5 MEDIATED ANGIOGENESIS The Scripps Research Institute (US) 1999-04-14 EP disclosed
EP-0710657-B1 Antagonists of adhesion receptors MERCK PATENT GMBH (DE) 1998-08-26 EP disclosed
EP-0844874-A1 METHODS AND COMPOSITIONS USEFUL FOR INHIBITION OF $g(a) v?$g(b) 5? MEDIATED ANGIOGENESIS THE SCRIPPS RESEARCH INSTITUTE (US) 1998-06-03 EP disclosed
WO-1997045447-A9 METHODS AND COMPOSITIONS USEFUL FOR INHIBITION OF αvβ5 MEDIATED ANGIOGENESIS 1998-03-12 WO disclosed
WO-1997045137-A1 METHODS AND COMPOSITIONS USEFUL FOR INHIBITION OF ANGIOGENESIS THE SCRIPPS RESEARCH INSTITUTE (US) 1997-12-04 WO disclosed
WO-1997045447-A1 METHODS AND COMPOSITIONS USEFUL FOR INHIBITION OF αvβ5 MEDIATED ANGIOGENESIS THE SCRIPPS RESEARCH INSTITUTE (US) 1997-12-04 WO disclosed
WO-1997006791-A9 METHODS AND COMPOSITIONS USEFUL FOR INHIBITION OF αvβ5 MEDIATED ANGIOGENESIS 1997-04-03 WO disclosed
WO-1997006791-A1 METHODS AND COMPOSITIONS USEFUL FOR INHIBITION OF αvβ5 MEDIATED ANGIOGENESIS THE SCRIPPS RESEARCH INSTITUTE (US) 1997-02-27 WO disclosed
EP-0710657-A1 Antagonists of adhesion receptors MERCK PATENT GmbH (DE) 1996-05-08 EP 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 (4 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-20040063790-A1 Methods for inhibition of angiogenesis FLT4, ANXA3, VCAM1 GRM2 1818/4885ITGB3 79/4885ITGA2B 1413/4885
US-20030176334-A1 Methods and compositions useful for inhibition of angiogenesis VCAM1, FLT4, TEK GRM2 3140/4885ITGB3 10/4885ITGA2B 212/4885
US-20060165703-A1 Methods and compositions useful for inhibition of alpha v beta 5 mediated angiogenesis ITGA5, ITGB5, ITGAV GRM2 3382/4885ITGB3 11/4885ITGA2B 21/4885
US-20060270710-A1 Methods for inhibition of angiogenesis FLT4, KDR, FLT1 GRM2 2267/4885ITGB3 5/4885ITGA2B 71/4885

“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.