SCHEMBL1772541

SCHEMBL1772541

Cc1cc(C)c2cccc(C(O)c3c(Cl)ccc(S(=O)(=O)N4CCCC4C(=O)N4CCN(C(=O)c5ccc(C(=N)N)cc5)CC4)c3Cl)c2n1

nearest known ligand 0.54

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
BDKRB2 P30411 3/20 0.54
RORC P51449 16/20 0.46
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
SCHEMBL2338647 0.86 BDKRB2 (0.46) BDKRB2RORCPOLB
SCHEMBL1560922 0.85 BDKRB2 (0.55) BDKRB2RORCPOLB
SCHEMBL2638880 0.84 RORC (0.55) BDKRB2RORC
SCHEMBL1772938 0.84 BDKRB2 (0.75) BDKRB2RORC
SCHEMBL6442652 0.84 BDKRB2 (0.75) BDKRB2RORC
Hydrochloric Acid SCHEMBL8182811 0.83 BDKRB2 (0.74) BDKRB2RORC
Hydrochloric Acid SCHEMBL8182794 0.83 BDKRB2 (0.74) BDKRB2RORC
SCHEMBL8443100 0.83 BDKRB2 (0.73) BDKRB2RORC
SCHEMBL8443103 0.83 BDKRB2 (0.73) BDKRB2RORC
SCHEMBL8183485 0.80 BDKRB2 (0.66) BDKRB2RORC

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2303268-B1 PHARMACEUTICAL COMPOSITIONS BASED ON KININ B2 RECEPTOR ANTAGONISTS AND CORTICOSTEROIDS, AND THEIR USE LUSO FARMACO INST (IT) 2012-06-20 EP claimed
EP-2222275-B1 PHARMACEUTICAL COMPOSITIONS CONTAINING BRADYKININ ANTAGONISTS AND HYALURONIC ACID, AND USES THEREOF LUSO FARMACO INST (IT) 2011-10-19 EP claimed
US-20110112011-A1 PHARMACEUTICAL COMPOSITIONS BASED ON KININ B2 RECEPTOR ANTAGONISTS AND CORTICOSTEROIDS, AND THEIR USE ISTITUTO LUSO FARMACO D'ITALIA S.P.A. (IT) 2011-05-12 US claimed
US-20100292156-A1 PHARMACEUTICAL COMPOSITIONS CONTAINING BRADYKININ ANTAGONISTS AND HYALURONIC ACID, AND USES THEREOF ISTITUTO LUSO FARMACO D'ITALIA S.P.A. (IT) 2010-11-18 US claimed
EP-2222275-A2 PHARMACEUTICAL COMPOSITIONS CONTAINING BRADYKININ ANTAGONISTS AND HYALURONIC ACID, AND USES THEREOF Istituto Luso Farmaco d'Italia S.p.A. (IT) 2010-09-01 EP claimed
WO-2009065507-A2 PHARMACEUTICAL COMPOSITIONS CONTAINING BRADYKININ ANTAGONISTS AND HYALURONIC ACID, AND USES THEREOF ISTITUTO LUSO FARMACO D'ITALIA S.P.A. (IT) 2009-05-28 WO claimed
US-9101627-B2 Pharmaceutical compositions containing bradykinin antagonists and hyaluronic acid, and uses thereof ISTITUTO LUSO FARMACO D'ITALIA S.P.A. (IT) 2015-08-11 US disclosed
EP-2222275-B1 PHARMACEUTICAL COMPOSITIONS CONTAINING BRADYKININ ANTAGONISTS AND HYALURONIC ACID, AND USES THEREOF LUSO FARMACO INST (IT) 2011-10-19 EP disclosed
US-20100292156-A1 PHARMACEUTICAL COMPOSITIONS CONTAINING BRADYKININ ANTAGONISTS AND HYALURONIC ACID, AND USES THEREOF ISTITUTO LUSO FARMACO D'ITALIA S.P.A. (IT) 2010-11-18 US disclosed
EP-2222275-A2 PHARMACEUTICAL COMPOSITIONS CONTAINING BRADYKININ ANTAGONISTS AND HYALURONIC ACID, AND USES THEREOF Istituto Luso Farmaco d'Italia S.p.A. (IT) 2010-09-01 EP disclosed
WO-2009065507-A2 PHARMACEUTICAL COMPOSITIONS CONTAINING BRADYKININ ANTAGONISTS AND HYALURONIC ACID, AND USES THEREOF ISTITUTO LUSO FARMACO D'ITALIA S.P.A. (IT) 2009-05-28 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 (2 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-20110112011-A1 PHARMACEUTICAL COMPOSITIONS BASED ON KININ B2 RECEPTOR ANTAGONISTS AND CORTICOSTEROIDS, AND THEIR USE BDKRB2, PTGER2, PTGER1 BDKRB2 1/4885RORC 945/4885POLB 1538/4885
US-20100292156-A1 PHARMACEUTICAL COMPOSITIONS CONTAINING BRADYKININ ANTAGONISTS AND HYALURONIC ACID, AND USES THEREOF BDKRB2, BDKRB1, HCAR2 BDKRB2 1/4885RORC 3493/4885POLB 3555/4885

“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.