SCHEMBL704920

SCHEMBL704920

CCCCCc1cc(O)cc(O)n1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 5/20 0.52
CYP3A4 P08684 2/20 0.52
GPR84 Q9NQS5 10/20 0.47
KCNH2 Q12809 1/20 0.46
ESR1 P03372 2/20 0.41
ADRA2A P08913 2/20 0.41
ADORA3 P0DMS8 2/20 0.41
TACR2 P21452 2/20 0.41
SLC6A2 P23975 2/20 0.41
SLC6A4 P31645 2/20 0.41
SLC6A3 Q01959 2/20 0.41
KDM4E B2RXH2 1/20 0.41
ALDH1A1 P00352 1/20 0.41
LMNA P02545 1/20 0.41
SHBG P04278 1/20 0.41
TP53 P04637 1/20 0.41
HSPD1 P10809 1/20 0.41
ADRB3 P13945 1/20 0.41
HTR2C P28335 1/20 0.41
HSPE1 P61604 1/20 0.41

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
SCHEMBL19357607 0.98 PTGS2 (0.53) PTGS2CYP3A4GPR84KCNH2ESR1
SCHEMBL30727511 0.98 PTGS2 (0.53) PTGS2CYP3A4GPR84KCNH2ESR1
SCHEMBL22738178 0.81 BACE1 (0.35) ACHE
SCHEMBL8414491 0.80 PTGS2 (0.50) PTGS2CYP3A4GPR84KCNH2ESR1
SCHEMBL8523463 0.78 HRH2 (0.47) PTGS2CYP3A4GPR84KCNH2
SCHEMBL8944425 0.78 GPR84 (0.45) PTGS2CYP3A4GPR84KCNH2ESR1
SCHEMBL31287855 0.78 ALOX5 (0.49) PTGS2CYP3A4GPR84KCNH2
SCHEMBL31287819 0.78 PTGS2 (0.51) PTGS2GPR84KCNH2
SCHEMBL9662963 0.77 NOS3 (0.39) PTGS2CYP3A4GPR84ESR1ALDH1A1
SCHEMBL23880689 0.77 CDK1 (0.48) PTGS2GPR84KCNH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8476439-B2 Pyridine classical cannabinoid compounds and related methods of use THE UNIVERSITY OF TENNESSEE RESEARCH FOUNDATION (US) 2013-07-02 US disclosed
US-8476439-B2 Pyridine classical cannabinoid compounds and related methods of use THE UNIVERSITY OF TENNESSEE RESEARCH FOUNDATION (US) 2013-07-02 US disclosed
US-8476439-B2 Pyridine classical cannabinoid compounds and related methods of use THE UNIVERSITY OF TENNESSEE RESEARCH FOUNDATION (US) 2013-07-02 US disclosed
US-8431595-B2 Furanopyridine cannabinoid compounds and related methods of use THE UNIVERSITY OF TENNESSEE RESEARCH FOUNDATION (US) 2013-04-30 US disclosed
US-8431595-B2 Furanopyridine cannabinoid compounds and related methods of use THE UNIVERSITY OF TENNESSEE RESEARCH FOUNDATION (US) 2013-04-30 US disclosed
US-8431595-B2 Furanopyridine cannabinoid compounds and related methods of use THE UNIVERSITY OF TENNESSEE RESEARCH FOUNDATION (US) 2013-04-30 US disclosed
US-20120220773-A1 PYRIDINE CLASSICAL CANNABINOID COMPOUNDS AND RELATED METHODS OF USE THE UNIVERSITY OF TENNESSEE RESEARCH FOUNDATION 2012-08-30 US disclosed
US-20120220773-A1 PYRIDINE CLASSICAL CANNABINOID COMPOUNDS AND RELATED METHODS OF USE THE UNIVERSITY OF TENNESSEE RESEARCH FOUNDATION 2012-08-30 US disclosed
US-20120220773-A1 PYRIDINE CLASSICAL CANNABINOID COMPOUNDS AND RELATED METHODS OF USE THE UNIVERSITY OF TENNESSEE RESEARCH FOUNDATION 2012-08-30 US disclosed
US-8124771-B2 Pyridine classical cannabinoid compounds and related methods of use UNIVERSITY OF TENNESSEE RESEARCH FOUNDATION (US) 2012-02-28 US disclosed
EP-2299817-A1 PYRIDINE CLASSICAL CANNABINOID COMPOUNDS AND RELATED METHODS OF USE The University of Tennessee Research Foundation (US) 2011-03-30 EP disclosed
US-20110046176-A1 FURANOPYRIDINE CANNABINOID COMPOUNDS AND RELATED METHODS OF USE THE UNIVERSITY OF TENNESSEE RESEARCH FOUNDATION 2011-02-24 US disclosed
US-20110046176-A1 FURANOPYRIDINE CANNABINOID COMPOUNDS AND RELATED METHODS OF USE THE UNIVERSITY OF TENNESSEE RESEARCH FOUNDATION 2011-02-24 US disclosed
WO-2011022692-A2 FURANOPYRIDINE CANNABINOID COMPOUNDS AND RELATED METHODS OF USE UNIVERSITY OF TENNESSEE RESEARCH FOUNDATION, THE (US) 2011-02-24 WO disclosed
WO-2011022692-A2 FURANOPYRIDINE CANNABINOID COMPOUNDS AND RELATED METHODS OF USE UNIVERSITY OF TENNESSEE RESEARCH FOUNDATION, THE (US) 2011-02-24 WO disclosed
WO-2009143179-A1 PYRIDINE CLASSICAL CANNABINOID COMPOUNDS AND RELATED METHODS OF USE UNIVERSIYT OF TENNESSEE RESEARCH FOUNDATION, THE (US) 2009-11-26 WO disclosed
WO-2009143179-A1 PYRIDINE CLASSICAL CANNABINOID COMPOUNDS AND RELATED METHODS OF USE UNIVERSIYT OF TENNESSEE RESEARCH FOUNDATION, THE (US) 2009-11-26 WO disclosed
US-20090286824-A1 Pyridine Classical Cannabinoid Compounds and Related Methods of Use THE UNIVERSITY OF TENNESSEE RESEARCH FOUNDATION 2009-11-19 US disclosed
US-20090286824-A1 Pyridine Classical Cannabinoid Compounds and Related Methods of Use THE UNIVERSITY OF TENNESSEE RESEARCH FOUNDATION 2009-11-19 US disclosed
US-20090286824-A1 Pyridine Classical Cannabinoid Compounds and Related Methods of Use THE UNIVERSITY OF TENNESSEE RESEARCH FOUNDATION 2009-11-19 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 (3 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-20110046176-A1 FURANOPYRIDINE CANNABINOID COMPOUNDS AND RELATED METHODS OF USE CNR1, CNR2, FAAH PTGS2 432/4885CYP3A4 554/4885GPR84 156/4885
US-20090286824-A1 Pyridine Classical Cannabinoid Compounds and Related Methods of Use CNR1, CNR2, NPY1R PTGS2 1233/4885CYP3A4 483/4885GPR84 108/4885
US-20120220773-A1 PYRIDINE CLASSICAL CANNABINOID COMPOUNDS AND RELATED METHODS OF USE CNR1, CNR2, NPY1R PTGS2 1233/4885CYP3A4 483/4885GPR84 108/4885

“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.