SCHEMBL2833669

SCHEMBL2833669

O=C(O)CC(Oc1ccc(NC(=O)c2ccc(NC3=NCCN3)cc2)cc1)c1ccccc1

nearest known ligand 0.49

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PTGIR P43119 7/20 0.49
ADRA2A P08913 5/20 0.48
GPR65 Q8IYL9 1/20 0.48
ADRA2B P18089 4/20 0.48
ADRA2C P18825 4/20 0.48
ITGB3 P05106 3/20 0.45
ITGAV P06756 3/20 0.45
ITGA2B P08514 3/20 0.45
ITGB1 P05556 2/20 0.42
ITGB5 P18084 2/20 0.42
F12 P00748 1/20 0.42
PRSS1 P07477 1/20 0.42
PRSS2 P07478 1/20 0.42
PRSS3 P35030 1/20 0.42

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
SCHEMBL2836221 0.94 ITGB3 (0.49) PTGIRADRA2AGPR65ADRA2BADRA2C
SCHEMBL2837795 0.92 PTGIR (0.46) PTGIRADRA2AGPR65ADRA2BADRA2C
SCHEMBL2832066 0.92 ITGB3 (0.48) PTGIRADRA2AGPR65ADRA2BADRA2C
SCHEMBL2841214 0.91 ITGB3 (0.56) ITGB3ITGAVITGA2BITGB1ITGB5
SCHEMBL2838710 0.88 ADRA2A (0.47) PTGIRADRA2AGPR65ADRA2BADRA2C
SCHEMBL2838085 0.87 ITGB3 (0.46) PTGIRADRA2AGPR65ITGB3ITGAV
SCHEMBL2833536 0.87 ITGB3 (0.55) ITGB3ITGAVITGA2BITGB1ITGB5
SCHEMBL2841479 0.86 ITGB3 (0.60) ITGB3ITGAVITGA2BITGB1ITGB5
SCHEMBL2837241 0.84 ITGB3 (0.54) ITGB3ITGAVITGA2BITGB1ITGB5
SCHEMBL2838049 0.84 ITGB3 (0.48) PTGIRADRA2AADRA2BADRA2CITGB3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030144311-A1 Propanoic acid derivatives as intergrin receptor antagonists PHARMACIA ITALIA S.P.A. (IT) 2003-07-31 US claimed
EP-1282602-A1 PROPANOIC ACID DERIVATIVES AS INTEGRIN RECEPTOR ANTAGONISTS Pharmacia Italia S.p.A. (IT) 2003-02-12 EP claimed
WO-2001087840-A1 PROPANOIC ACID DERIVATIVES AS INTEGRIN RECEPTOR ANTAGONISTS PHARMACIA ITALIA S.P.A. (IT) 2001-11-22 WO claimed
US-20180344803-A1 Methods and Compositions For the Treatment of Proteinuric Diseases THE GENERAL HOSPITAL CORPORATION 2018-12-06 US disclosed
US-20160296592-A1 Methods and Compositions for the Treatment of Proteinuric Diseases THE GENERAL HOSPITAL CORPORATION 2016-10-13 US disclosed
US-9345739-B2 Methods and compositions for the treatment of proteinuric diseases THE GENERAL HOSPITAL CORPORATION (US) 2016-05-24 US disclosed
US-20100297139-A1 METHODS AND COMPOSITIONS FOR THE TREATMENT OF PROTEINURIC DISEASES THE GENERAL HOSPITAL CORPORATION 2010-11-25 US disclosed
US-6974828-B2 Propanoic acid derivatives as intergrin receptor antagonists PHARMACIA ITALIA S.P.A. (IT) 2005-12-13 US disclosed
EP-1282602-B1 PROPANOIC ACID DERIVATIVES AS INTEGRIN RECEPTOR ANTAGONISTS PHARMACIA ITALIA SPA (IT) 2005-09-21 EP disclosed
US-20030144311-A1 Propanoic acid derivatives as intergrin receptor antagonists PHARMACIA ITALIA S.P.A. (IT) 2003-07-31 US disclosed
EP-1282602-A1 PROPANOIC ACID DERIVATIVES AS INTEGRIN RECEPTOR ANTAGONISTS Pharmacia Italia S.p.A. (IT) 2003-02-12 EP disclosed
WO-2001087840-A1 PROPANOIC ACID DERIVATIVES AS INTEGRIN RECEPTOR ANTAGONISTS PHARMACIA ITALIA S.P.A. (IT) 2001-11-22 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 (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-20160296592-A1 Methods and Compositions for the Treatment of Proteinuric Diseases ITGB3, PLAUR, PROC PTGIR 1584/4885ADRA2A 2593/4885GPR65 1064/4885
US-20180344803-A1 Methods and Compositions For the Treatment of Proteinuric Diseases ITGB3, PLAUR, PROC PTGIR 1584/4885ADRA2A 2593/4885GPR65 1064/4885
US-20100297139-A1 METHODS AND COMPOSITIONS FOR THE TREATMENT OF PROTEINURIC DISEASES ITGB3, PLAUR, PROC PTGIR 1584/4885ADRA2A 2593/4885GPR65 1064/4885
US-20030144311-A1 Propanoic acid derivatives as intergrin receptor antagonists ITGB3, HCAR3, ADRB3 PTGIR 39/4885ADRA2A 203/4885GPR65 69/4885

“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.