SCHEMBL747027

SCHEMBL747027

O=CC(=O)Nc1c[nH]c2ccccc12

nearest known ligand 0.55

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
STING1 Q86WV6 13/20 0.55
GPR84 Q9NQS5 1/20 0.47
CYP2A6 P11509 1/20 0.47
IMPDH2 P12268 1/20 0.47
NR4A2 P43354 1/20 0.45
CREBBP Q92793 1/20 0.45
PBRM1 Q86U86 1/20 0.45

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
SCHEMBL178065 0.85 STING1 (0.54) STING1GPR84
SCHEMBL28736881 0.82 STING1 (0.74) STING1GPR84NR4A2CREBBPPBRM1
SCHEMBL384965 0.81 STING1 (0.63) STING1GPR84
SCHEMBL4490274 0.81 STING1 (0.59) STING1GPR84NR4A2CREBBP
SCHEMBL1596152 0.79 STING1 (0.61) STING1GPR84NR4A2CREBBPPBRM1
SCHEMBL4103760 0.79 STING1 (0.60) STING1NR4A2CREBBPPBRM1
SCHEMBL5894412 0.78 STING1 (0.56) STING1GPR84
SCHEMBL4092376 0.78 STING1 (0.59) STING1
SCHEMBL13134373 0.77 STING1 (0.56) STING1GPR84
SCHEMBL23167581 0.77 STING1 (0.58) STING1GPR84NR4A2CREBBP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2431029-B1 Method of inhibiting prostate cancer cell proliferation SCOTT KIERAN FRANCIS (AU) 2014-07-30 EP disclosed
EP-1531803-B1 METHOD OF INHIBITING PROSTATE CANCER CELL PROLIFERATION SCOTT KIERAN FRANCIS (AU) 2013-05-15 EP disclosed
EP-2431029-A2 Method of inhibiting prostate cancer cell proliferation Scott, Kieran Francis (AU) 2012-03-21 EP disclosed
US-8026271-B2 Formulations of indol-3-yl-2-oxoacetamide compounds NATIONAL HEALTH RESEARCH INSTITUTES (TW) 2011-09-27 US disclosed
US-20110195915-A1 Method of inhibiting prostate cancer cell proliferation SCOTT, KIERAN, FRANCIS (AU) 2011-08-11 US disclosed
US-7919458-B2 Using phospholipase inhibitor as therapeutic in treatment of cancer disorders SCOTT, KIERAN, FRANCIS (AU) 2011-04-05 US disclosed
US-7662834-B2 Methods of 1H-indol-3-yl-2-oxoacetamide compounds NATIONAL HEALTH RESEARCH INSTITUTES (TW) 2010-02-16 US disclosed
EP-1531803-A4 METHOD OF INHIBITING PROSTATE CANCER CELL PROLIFERATION SCOTT KIERAN FRANCIS (AU) 2009-08-05 EP disclosed
EP-1569902-B1 SUBSTITUTED INDOLE OXO-ACETYL AMINO ACETIC ACID DERIVATIVES AS INHIBITORS OF PLASMINOGEN ACTIVATOR INHIBITOR-1 (PAI-1) WYETH CORP (US) 2009-05-06 EP disclosed
US-7396838-B2 Use of 1H-indol-3-yl-2-oxoacetamide compounds NATIONAL HEALTH RESEARCH INSTITUTES (TW) 2008-07-08 US disclosed
EP-1569902-A1 SUBSTITUTED INDOLE OXO-ACETYL AMINO ACETIC ACID DERIVATIVES AS INHIBITORS OF PLASMINOGEN ACTIVATOR INHIBITOR-1 (PAI-1) Wyeth (US) 2005-09-07 EP disclosed
US-6903104-B2 Indol-3-YL-2-oxoacetamide compounds and methods of use thereof NATIONAL HEALTH RESEARCH INSTITUTES (TW) 2005-06-07 US disclosed
EP-1531803-A1 METHOD OF INHIBITING PROSTATE CANCER CELL PROLIFERATION Scott, Kieran Francis (AU) 2005-05-25 EP disclosed
US-20040266762-A1 Indole derivatives having an apoptosis-inducing effect AETERNA ZENTARIS GMBH (DE) 2004-12-30 US disclosed
WO-2004064822-A1 METHOD OF INHIBITING PROSTATE CANCER CELL PROLIFERATION SCOTT KIERAN FRANCIS (AU) 2004-08-05 WO disclosed
WO-2004052856-A1 SUBSTITUTED INDOLE OXO-ACETYL AMINO ACETIC ACID DERIVATIVES AS INHIBITORS OF PLASMINOGEN ACTIVATOR INHIBITOR-1 (PAI-1) WYETH (US) 2004-06-24 WO disclosed
US-20040077557-A1 Macrolide antibiotics GLAXO GROUP LIMITED (GB) 2004-04-22 US disclosed
EP-1363925-A1 MACROLIDE ANTIBIOTICS GLAXO GROUP LIMITED (GB) 2003-11-26 EP disclosed
CN-1413205-A 2- (1H-indol-3-yl) -2-oxo-acetamides with antitumor activity NOVUSPHARMA SPA (IT) 2003-04-23 CN disclosed
WO-2002050091-A1 MACROLIDE ANTIBIOTICS GLAXO GROUP LIMITED (GB) 2002-06-27 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-20040266762-A1 Indole derivatives having an apoptosis-inducing effect BAD, API5, AIFM1 STING1 1342/4885GPR84 1113/4885CYP2A6 2480/4885
US-20040077557-A1 Macrolide antibiotics MALT1, MRPL21, IL1R1 STING1 2460/4885GPR84 1923/4885CYP2A6 562/4885

“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.