SCHEMBL6497993

SCHEMBL6497993

O=C(CCc1ccc(C(=O)NC[C@H](NS(=O)(=O)c2cccc3ccccc23)C(=O)O)cc1)NC1=NCCCN1

nearest known ligand 0.76

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ITGB3 P05106 20/20 0.76
ITGAV P06756 20/20 0.76
ITGA2B P08514 19/20 0.76

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
SCHEMBL6829353 0.91 ITGB3 (0.63) ITGB3ITGAVITGA2B
SCHEMBL6832543 0.90 ITGB3 (0.62) ITGB3ITGAVITGA2B
SCHEMBL6831996 0.90 ITGB3 (0.62) ITGB3ITGAVITGA2B
SCHEMBL6832492 0.90 ITGB3 (0.76) ITGB3ITGAVITGA2B
SCHEMBL6831991 0.90 ITGB3 (0.62) ITGB3ITGAVITGA2B
SCHEMBL6505263 0.89 ITGB3 (0.69) ITGB3ITGAVITGA2B
SCHEMBL6831975 0.89 ITGB3 (0.61) ITGB3ITGAVITGA2B
SCHEMBL6829170 0.89 ITGB3 (0.60) ITGB3ITGAVITGA2B
SCHEMBL6832958 0.88 ITGB3 (0.68) ITGB3ITGAVITGA2B
SCHEMBL6829164 0.87 ITGB3 (0.62) ITGB3ITGAVITGA2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6900318-B1 1,4,5,6-tetrahydropyrimidine derivative as a vitronectin inhibitor AVENTIS PHARMA DEUTSCLAND GMBH (DE) 2005-05-31 US claimed
EP-1204646-B1 1,4,5,6 -TETRAHYDROPYRIMIDINE DERIVATIVE AS A VITRONECTIN INHIBITOR AVENTIS PHARMA GMBH (DE) 2004-12-29 EP claimed
US-20020065271-A1 Novel sulfonamide derivatives as inhibitors of bone resorption and as inhibitors of cell adhesion PEYMAN ANUSCHIRWAN (DE) 2002-05-30 US claimed
EP-1204646-A1 1,4,5,6 -TETRAHYDROPYRIMIDINE DERIVATIVE AS A VITRONECTIN INHIBITOR Aventis Pharma Deutschland GmbH (DE) 2002-05-15 EP claimed
US-6313119-B1 VITRONECTIN RECEPTOR ANTAGONISTS ADVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2001-11-06 US claimed
WO-2001007417-A1 1,4,5,6-TETRAHYDROPYRIMIDINE DERIVATIVE AS A VITRONECTIN INHIBITOR AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2001-02-01 WO claimed
EP-1070707-A1 1,4,5,6-tetrahydropyrimidine derivative as a vitronectin inhibitor Aventis Pharma Deutschland GmbH (DE) 2001-01-24 EP claimed
EP-1049677-A1 NOVEL SULFONAMIDE DERIVATIVES AS INHIBITORS OF BONE RESORPTION AND AS INHIBITORS OF CELL ADHESION Aventis Pharma Deutschland GmbH (DE) 2000-11-08 EP claimed
WO-1999037621-A1 NOVEL SULFONAMIDE DERIVATIVES AS INHIBITORS OF BONE RESORPTION AND AS INHIBITORS OF CELL ADHESION AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 1999-07-29 WO claimed
US-6900318-B1 1,4,5,6-tetrahydropyrimidine derivative as a vitronectin inhibitor AVENTIS PHARMA DEUTSCLAND GMBH (DE) 2005-05-31 US disclosed
US-6900318-B1 1,4,5,6-tetrahydropyrimidine derivative as a vitronectin inhibitor AVENTIS PHARMA DEUTSCLAND GMBH (DE) 2005-05-31 US disclosed
EP-1204646-B1 1,4,5,6 -TETRAHYDROPYRIMIDINE DERIVATIVE AS A VITRONECTIN INHIBITOR AVENTIS PHARMA GMBH (DE) 2004-12-29 EP disclosed
EP-1204646-B1 1,4,5,6 -TETRAHYDROPYRIMIDINE DERIVATIVE AS A VITRONECTIN INHIBITOR AVENTIS PHARMA GMBH (DE) 2004-12-29 EP disclosed
US-6747148-B2 FOR THERPY AND PROPHYLAXIS OF OSTEOPOROSIS, HYPERCALCEMIA, OR OSTEOPENIA, INFLAMMATION, CARDIOVASCULAR DISORDERS, RESTENOSIS, ARTERIOSCLEROSIS, NEPHROPATHIES OR RETINOPATHIES HOECHST MARION ROUSSEL DEUTSCHLAND GMBH (DE) 2004-06-08 US disclosed
WO-2001007417-A1 1,4,5,6-TETRAHYDROPYRIMIDINE DERIVATIVE AS A VITRONECTIN INHIBITOR AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2001-02-01 WO disclosed
WO-2001007417-A1 1,4,5,6-TETRAHYDROPYRIMIDINE DERIVATIVE AS A VITRONECTIN INHIBITOR AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2001-02-01 WO disclosed
EP-1070707-A1 1,4,5,6-tetrahydropyrimidine derivative as a vitronectin inhibitor Aventis Pharma Deutschland GmbH (DE) 2001-01-24 EP disclosed
EP-1070707-A1 1,4,5,6-tetrahydropyrimidine derivative as a vitronectin inhibitor Aventis Pharma Deutschland GmbH (DE) 2001-01-24 EP disclosed
EP-1049677-A1 NOVEL SULFONAMIDE DERIVATIVES AS INHIBITORS OF BONE RESORPTION AND AS INHIBITORS OF CELL ADHESION Aventis Pharma Deutschland GmbH (DE) 2000-11-08 EP disclosed
WO-1999037621-A1 NOVEL SULFONAMIDE DERIVATIVES AS INHIBITORS OF BONE RESORPTION AND AS INHIBITORS OF CELL ADHESION AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 1999-07-29 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 (1 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-20020065271-A1 Novel sulfonamide derivatives as inhibitors of bone resorption and as inhibitors of cell adhesion SOST, SELPLG, BST2 ITGB3 84/4885ITGAV 159/4885ITGA2B 39/4885

“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.