SCHEMBL244149

SCHEMBL244149

CCOC(=O)C1(c2ccc(CCl)s2)CC=CC1

nearest known ligand 0.38

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 10/20 0.37
OPRD1 P41143 3/20 0.36
OPRK1 P41145 3/20 0.36
SLC22A1 O15245 1/20 0.36
SLC6A4 P31645 1/20 0.36
ADRA1A P35348 1/20 0.36
KCNH2 Q12809 1/20 0.36
POLB P06746 1/20 0.35

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
SCHEMBL7419947 0.84 ALDH1A1 (0.40) OPRM1OPRD1OPRK1SLC22A1SLC6A4
SCHEMBL7416829 0.80 HDAC4 (0.33)
SCHEMBL240032 0.78 OPRM1 (0.39) OPRM1OPRD1OPRK1SLC22A1SLC6A4
SCHEMBL244317 0.73 OPRM1 (0.43) OPRM1OPRD1OPRK1SLC22A1SLC6A4
SCHEMBL7419267 0.72 AGTR1 (0.37)
SCHEMBL2884118 0.70
SCHEMBL5860380 0.70 OPRM1 (0.64) OPRM1OPRD1OPRK1SLC22A1SLC6A4
SCHEMBL7413465 0.69 POLB (0.39) OPRM1OPRD1OPRK1SLC22A1SLC6A4
SCHEMBL16564364 0.67 SMN1; SMN2 (0.50)
SCHEMBL6814615 0.67 HDAC3 (0.55) POLB

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
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-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
US-5789415-A Azacyclic-heterocyclic compounds as angiotension II receptor antagonists PFIZER INC. (US) 1998-08-04 US 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 (5 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 OPRM1 243/4885OPRD1 214/4885OPRK1 66/4885
US-20060223741-A1 Method of treatment or prophylaxis AGTR2, AGTR1, NTSR2 OPRM1 243/4885OPRD1 214/4885OPRK1 66/4885
US-20160052925-A1 METHOD OF TREATMENT OR PROPHYLAXIS INFTAMMATORY PAIN AGTR2, AGTR1, BDKRB2 OPRM1 96/4885OPRD1 125/4885OPRK1 44/4885
US-20140142116-A1 Method of Treatment or Prophylaxis of Inflammatory Pain AGTR2, AGTR1, BDKRB2 OPRM1 189/4885OPRD1 129/4885OPRK1 23/4885
US-20140228362-A1 Method of Treatment or Prophylaxis AGTR2, AGTR1, NTSR2 OPRM1 243/4885OPRD1 214/4885OPRK1 66/4885

“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.