SCHEMBL243873

SCHEMBL243873

CCCc1nc(CC)c(C(=O)OCC#CC(=O)N(c2ccccc2)c2ccccc2)n1Cc1ccc(-c2ccccc2-c2nnn[nH]2)cc1

nearest known ligand 0.81

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
AGTR1 P30556 13/20 0.81
AGTR2 P50052 12/20 0.81

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
SCHEMBL2925769 0.89 AGTR1 (0.82) AGTR1AGTR2
SCHEMBL243845 0.88 AGTR1 (0.62) AGTR1AGTR2
SCHEMBL9389798 0.85 AGTR1 (0.64) AGTR1AGTR2
SCHEMBL9389326 0.84 AGTR1 (0.62) AGTR1AGTR2
SCHEMBL9198706 0.83 AGTR1 (0.62) AGTR1AGTR2
SCHEMBL6556676 0.83 AGTR1 (0.73) AGTR1AGTR2
SCHEMBL9426570 0.83 AGTR1 (0.64) AGTR1AGTR2
SCHEMBL9386209 0.82 AGTR1 (0.61) AGTR1AGTR2
SCHEMBL9385911 0.82 AGTR1 (0.60) AGTR1AGTR2
SCHEMBL7310985 0.81 AGTR1 (0.61) AGTR1AGTR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160052925-A1 METHOD OF TREATMENT OR PROPHYLAXIS INFTAMMATORY PAIN NOVARTIS AG (CH) 2016-02-25 US disclosed
US-9227968-B2 Method of treatment or prophylaxis of inflammatory pain NOVARTIS AG (CH) 2016-01-05 US disclosed
US-9018207-B2 Method of treatment or prophylaxis SPINIFEX PHARMACEUTICALS PTY LTD (AU) 2015-04-28 US disclosed
US-20140228362-A1 Method of Treatment or Prophylaxis SPINIFEX PHARMACEUTICALS PTY LTD (AU) 2014-08-14 US disclosed
US-20140142116-A1 Method of Treatment or Prophylaxis of Inflammatory Pain SPINIFEX PHARMACEUTICALS PTY LTD (AU) 2014-05-22 US disclosed
US-8722675-B2 Method of treatment or prophylaxis SPINIFEX PHARMACEUTICALS PTY LTD (AU) 2014-05-13 US disclosed
US-20130296350-A1 Method of Treatment or Prophylaxis NOVARTIS AG (CH) 2013-11-07 US disclosed
US-8551950-B2 Method of treatment or prophylaxis of inflammatory pain SPINIFEX PHARMACEUTICALS PTY LTD (AU) 2013-10-08 US disclosed
US-8492382-B2 Method of treatment or prophylaxis SPINIFEX PHARMACEUTICALS PTY LTD (AU) 2013-07-23 US disclosed
US-8404686-B2 Method of treatment or prophylaxis SPINIFEX PHARMACEUTICALS PTY LTD (AU) 2013-03-26 US disclosed
US-20120004259-A1 METHOD OF TREATMENT OR PROPHYLAXIS SPINIFEX PHARMACEUTICALS, PTY LTD (AU) 2012-01-05 US disclosed
US-20110318329-A1 METHOD OF TREATMENT OR PROPHYLAXIS NOVARTIS AG (CH) 2011-12-29 US disclosed
US-20100292159-A1 METHOD OF TREATMENT OR PROPHYLAXIS OF INFLAMMATORY PAIN UNIVERSITY OF QUEENSLAND (AU) 2010-11-18 US disclosed
US-7828840-B2 Medical devices and methods for local delivery of angiotensin II type 2 receptor antagonists MED INSTITUTE, INC. (US) 2010-11-09 US disclosed
US-7795275-B2 Method of treatment or prophylaxis UNIQUEST PTY LIMITED (AU) 2010-09-14 US disclosed
US-20090177267-A1 Medical devices and methods for local delivery of angiotensin II type 2 receptor antagonists WILMINGTON TRUST, NATIONAL ASSOCIATION, AS COLLATERAL AGENT 2009-07-09 US disclosed
US-20060223741-A1 Method of treatment or prophylaxis THE UNIVERSITY OF QUEENSLAND (AU) 2006-10-05 US disclosed
US-5545651-A HYPOTENSIVE AGENTS THE DUPONT MERCK PHARMACEUTICAL COMPANY (US) 1996-08-13 US 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 (8 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-20130296350-A1 Method of Treatment or Prophylaxis AGTR2, AGTR1, NTSR2 AGTR1 2/4885AGTR2 1/4885
US-20060223741-A1 Method of treatment or prophylaxis AGTR2, AGTR1, NTSR2 AGTR1 2/4885AGTR2 1/4885
US-20160052925-A1 METHOD OF TREATMENT OR PROPHYLAXIS INFTAMMATORY PAIN AGTR2, AGTR1, BDKRB2 AGTR1 2/4885AGTR2 1/4885
US-20140142116-A1 Method of Treatment or Prophylaxis of Inflammatory Pain AGTR2, AGTR1, BDKRB2 AGTR1 2/4885AGTR2 1/4885
US-20140228362-A1 Method of Treatment or Prophylaxis AGTR2, AGTR1, NTSR2 AGTR1 2/4885AGTR2 1/4885
US-20120004259-A1 METHOD OF TREATMENT OR PROPHYLAXIS AGTR2, AGTR1, NTSR2 AGTR1 2/4885AGTR2 1/4885
US-20100292159-A1 METHOD OF TREATMENT OR PROPHYLAXIS OF INFLAMMATORY PAIN AGTR2, AGTR1, BDKRB2 AGTR1 2/4885AGTR2 1/4885
US-20110318329-A1 METHOD OF TREATMENT OR PROPHYLAXIS AGTR2, AGTR1, NTSR2 AGTR1 2/4885AGTR2 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.