SCHEMBL2833009

SCHEMBL2833009

N=C(NCc1ccccc1)Nc1ccc(C(=O)Nc2cccc([S+]([O-])C(CC(=O)O)c3ccccc3)c2)cc1

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HPSE Q9Y251 1/20 0.42
NAMPT P43490 5/20 0.41
ITGB3 P05106 3/20 0.40
ITGA2B P08514 2/20 0.40
ITGAV P06756 1/20 0.39
ACKR3 P25106 1/20 0.39
HDAC1 Q13547 1/20 0.39
PPARG P37231 2/20 0.38
KMT2A Q03164 3/20 0.38
POLB P06746 1/20 0.38
MEN1 O00255 1/20 0.38
SENP1 Q9P0U3 2/20 0.37
MIF P14174 1/20 0.37
SENP5 Q96HI0 1/20 0.37
SENP2 Q9HC62 1/20 0.37

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
SCHEMBL2838519 0.94 LMNA (0.43) ITGB3ITGA2BITGAVKMT2ASENP1
SCHEMBL4379581 0.92 NAMPT (0.46) NAMPTITGB3ITGA2BITGAVKMT2A
SCHEMBL2836929 0.92 NAMPT (0.46) NAMPTITGB3ITGA2BITGAVKMT2A
SCHEMBL2833516 0.92 NAMPT (0.42) NAMPTITGB3ITGA2BHDAC1PPARG
SCHEMBL2838511 0.91 ITGB3 (0.43) ITGB3ITGA2BITGAVPPARGKMT2A
SCHEMBL2833588 0.91 NAMPT (0.52) HPSENAMPTITGB3ITGAV
SCHEMBL2833800 0.86 ITGB3 (0.46) HPSEITGB3ITGA2BITGAVKMT2A
SCHEMBL2836312 0.86 NAMPT (0.44) NAMPTITGB3ITGA2BITGAVSENP1
SCHEMBL2834794 0.84 ITGB3 (0.47) NAMPTITGB3ITGAVKMT2ASENP1
SCHEMBL2839792 0.84 ITGB3 (0.43) HPSEITGB3ITGA2BITGAVKMT2A

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 14 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
EP-2730282-A1 Methods and compositions for the treatment of proteinuric diseases The General Hospital Corporation (US) 2014-05-14 EP disclosed
US-20100297139-A1 METHODS AND COMPOSITIONS FOR THE TREATMENT OF PROTEINURIC DISEASES THE GENERAL HOSPITAL CORPORATION 2010-11-25 US disclosed
WO-2009061448-A9 METHODS AND COMPOSITIONS FOR THE TREATMENT OF PROTEINURIC DISEASES THE GENERAL HOSPITAL CORPORATION (US) 2009-08-13 WO 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 HPSE 80/4885NAMPT 357/4885ITGB3 1/4885
US-20180344803-A1 Methods and Compositions For the Treatment of Proteinuric Diseases ITGB3, PLAUR, PROC HPSE 80/4885NAMPT 357/4885ITGB3 1/4885
US-20100297139-A1 METHODS AND COMPOSITIONS FOR THE TREATMENT OF PROTEINURIC DISEASES ITGB3, PLAUR, PROC HPSE 80/4885NAMPT 357/4885ITGB3 1/4885
US-20030144311-A1 Propanoic acid derivatives as intergrin receptor antagonists ITGB3, HCAR3, ADRB3 HPSE 3155/4885NAMPT 3667/4885ITGB3 1/4885

“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.