SCHEMBL2839147

SCHEMBL2839147

NC(=O)Nc1cccc(C(=O)Nc2ccccc2[S+]([O-])C(CC(=O)O)c2ccccc2)c1

nearest known ligand 0.44

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KCNK3 O14649 2/20 0.44
KCNK9 Q9NPC2 2/20 0.44
SIRT2 Q8IXJ6 3/20 0.43
ITGB3 P05106 5/20 0.40
ITGA2B P08514 5/20 0.40
PARP1 P09874 1/20 0.39
PARP10 Q53GL7 1/20 0.39
ITGAV P06756 3/20 0.39
KMT2A Q03164 3/20 0.38
MEN1 O00255 2/20 0.38
PKM P14618 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
POLB P06746 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
SCHEMBL2837317 0.92 ITGB3 (0.43) KCNK3KCNK9SIRT2ITGB3ITGA2B
SCHEMBL2839299 0.91 ITGB3 (0.49) KCNK3KCNK9ITGB3ITGA2BITGAV
SCHEMBL2838823 0.89 HDAC1 (0.42) SIRT2ITGB3ITGA2BITGAVPOLB
SCHEMBL2839463 0.86 ITGB3 (0.45) KCNK3KCNK9SIRT2ITGB3ITGAV
SCHEMBL2836503 0.86 ITGB3 (0.44) KCNK3KCNK9SIRT2ITGB3ITGA2B
SCHEMBL2836148 0.85 ITGB3 (0.48) KCNK3KCNK9SIRT2ITGB3ITGA2B
SCHEMBL2837837 0.84 SIRT2 (0.42) KCNK3KCNK9SIRT2ITGB3ITGA2B
SCHEMBL2837043 0.84 ITGB3 (0.47) KCNK3ITGB3ITGA2BITGAV
SCHEMBL2841583 0.84 ITGB3 (0.51) KCNK3KCNK9SIRT2ITGB3ITGAV
SCHEMBL18128309 0.83 KDM4E (0.42) KMT2ASMN1; SMN2POLB

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 KCNK3 1776/4885KCNK9 2386/4885SIRT2 2469/4885
US-20180344803-A1 Methods and Compositions For the Treatment of Proteinuric Diseases ITGB3, PLAUR, PROC KCNK3 1776/4885KCNK9 2386/4885SIRT2 2469/4885
US-20100297139-A1 METHODS AND COMPOSITIONS FOR THE TREATMENT OF PROTEINURIC DISEASES ITGB3, PLAUR, PROC KCNK3 1776/4885KCNK9 2386/4885SIRT2 2469/4885
US-20030144311-A1 Propanoic acid derivatives as intergrin receptor antagonists ITGB3, HCAR3, ADRB3 KCNK3 1585/4885KCNK9 3796/4885SIRT2 3845/4885

“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.