SCHEMBL244243

SCHEMBL244243

CCCCc1nc2cccc(C)c2c(=O)n1Cc1ccc(C2(OC=O)CC=CC2)s1

nearest known ligand 0.46

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 2/20 0.39
PDE4B Q07343 2/20 0.39
PDE4C Q08493 2/20 0.39
PDE4D Q08499 2/20 0.39
PDE3B Q13370 1/20 0.36
PDE3A Q14432 1/20 0.36
HTR1A P08908 1/20 0.36
ELANE P08246 3/20 0.35
PIK3CD O00329 1/20 0.34
AGTR1 P30556 1/20 0.33
AGTR2 P50052 1/20 0.33
CASR P41180 1/20 0.32

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
SCHEMBL244242 0.84 PDE4A (0.42) PDE4APDE4BPDE4CPDE4DPDE3B
SCHEMBL7423304 0.83 PDE4A (0.38) PDE4APDE4BPDE4CPDE4DPDE3B
SCHEMBL245600 0.75 PDE4A (0.42) PDE4APDE4BPDE4CPDE4DPDE3B
SCHEMBL7423441 0.74 PDE4A (0.39) PDE4APDE4BPDE4CPDE4DPDE3B
SCHEMBL244087 0.73 GPR4 (0.41) AGTR1AGTR2
SCHEMBL28451245 0.65 PIK3CD (0.50) PDE4APDE4BPDE4CPDE4DHTR1A
SCHEMBL7422046 0.64 AGTR1 (0.41) PDE4APDE4BPDE4CPDE4DAGTR1
SCHEMBL245599 0.64 PDE4A (0.45) PDE4APDE4BPDE4CPDE4DPDE3B
SCHEMBL7421353 0.63 PPARG (0.43) PDE4APDE4BPDE4CPDE4DAGTR1
SCHEMBL28826515 0.63 PDE4A (0.41) PDE4APDE4BPDE4CPDE4DAGTR1

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 23 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-1995002596-A1 AZACYCLIC-HETEROCYCLIC COMPOUNDS AS ANGIOTENSIN II RECEPTOR ANTAGONISTS PFIZER INC. (US) 1995-01-26 WO claimed
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-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
EP-1996183-A1 METHOD OF TREATMENT OR PROPHYLAXIS INFLAMMATORY PAIN THE UNIVERSITY OF QUEENSLAND (AU) 2008-12-03 EP disclosed
WO-2007106938-A1 METHOD OF TREATMENT OR PROPHYLAXIS INFLAMMATORY PAIN THE UNIVERSITY OF QUEENSLAND (AU) 2007-09-27 WO disclosed
EP-1830869-A1 METHOD OF TREATMENT OR PROPHYLAXIS THE UNIVERSITY OF QUEENSLAND (AU) 2007-09-12 EP disclosed
US-20060223741-A1 Method of treatment or prophylaxis THE UNIVERSITY OF QUEENSLAND (AU) 2006-10-05 US disclosed
WO-2006066361-A1 METHOD OF TREATMENT OR PROPHYLAXIS THE UNIVERSITY OF QUEENSLAND (AU) 2006-06-29 WO disclosed
WO-1995002596-A1 AZACYCLIC-HETEROCYCLIC COMPOUNDS AS ANGIOTENSIN II RECEPTOR ANTAGONISTS PFIZER INC. (US) 1995-01-26 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 (6 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 PDE4A 1314/4885PDE4B 1324/4885PDE4C 2043/4885
US-20060223741-A1 Method of treatment or prophylaxis AGTR2, AGTR1, NTSR2 PDE4A 1314/4885PDE4B 1324/4885PDE4C 2043/4885
US-20160052925-A1 METHOD OF TREATMENT OR PROPHYLAXIS INFTAMMATORY PAIN AGTR2, AGTR1, BDKRB2 PDE4A 2062/4885PDE4B 2250/4885PDE4C 2786/4885
US-20140142116-A1 Method of Treatment or Prophylaxis of Inflammatory Pain AGTR2, AGTR1, BDKRB2 PDE4A 2036/4885PDE4B 2254/4885PDE4C 3317/4885
US-20140228362-A1 Method of Treatment or Prophylaxis AGTR2, AGTR1, NTSR2 PDE4A 1314/4885PDE4B 1324/4885PDE4C 2043/4885
US-20100292159-A1 METHOD OF TREATMENT OR PROPHYLAXIS OF INFLAMMATORY PAIN AGTR2, AGTR1, BDKRB2 PDE4A 1924/4885PDE4B 2137/4885PDE4C 2997/4885

“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.