SCHEMBL2956494

SCHEMBL2956494

CCOC(=O)c1cccc(Cc2cc(Cl)ccc2OCC(C)C)n1

nearest known ligand 0.77

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PTGER1 P34995 17/20 0.77
CYP1A2 P05177 4/20 0.54
CYP2C9 P11712 4/20 0.54
TBXA2R P21731 2/20 0.53
PTGS1 P23219 2/20 0.53
CYP2C19 P33261 2/20 0.53
PTGER3 P43115 2/20 0.53
PTGER2 P43116 2/20 0.53

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
SCHEMBL2960283 0.91 PTGER1 (0.63) PTGER1CYP1A2CYP2C9TBXA2RPTGS1
SCHEMBL13902737 0.89 PTGER1 (0.80) PTGER1CYP1A2CYP2C9TBXA2RPTGS1
SCHEMBL2962415 0.87 PTGER1 (0.58) PTGER1CYP1A2CYP2C9TBXA2RPTGS1
SCHEMBL4152215 0.87 PTGER1 (1.00) PTGER1CYP1A2CYP2C9TBXA2RPTGS1
SCHEMBL2953318 0.86 PTGER1 (1.00) PTGER1CYP1A2CYP2C9TBXA2RPTGS1
SCHEMBL4067224 0.86 PTGER1 (0.82) PTGER1CYP1A2CYP2C9TBXA2RPTGS1
SCHEMBL3212344 0.86 PTGER1 (0.55) PTGER1CYP1A2CYP2C9TBXA2RPTGS1
SCHEMBL2954555 0.85 PTGER1 (0.77) PTGER1CYP1A2CYP2C9TBXA2RPTGS1
SCHEMBL2961699 0.84 PTGER1 (0.55) PTGER1CYP1A2CYP2C9TBXA2RPTGS1
SCHEMBL2961468 0.84 PTGER1 (0.77) PTGER1CYP1A2CYP2C9TBXA2RPTGS1

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-7759369-B2 Pyridine compounds for the treatment of prostaglandin mediated diseases GLAXO GROUP LIMITED (GB) 2010-07-20 US disclosed
US-7759369-B2 Pyridine compounds for the treatment of prostaglandin mediated diseases GLAXO GROUP LIMITED (GB) 2010-07-20 US disclosed
US-7759369-B2 Pyridine compounds for the treatment of prostaglandin mediated diseases GLAXO GROUP LIMITED (GB) 2010-07-20 US disclosed
US-20100137378-A1 Pyridine Compounds For The Treatment Of Prostaglandin Mediated Diseases GLAXO GROUP LIMITED (GB) 2010-06-03 US disclosed
US-20100137378-A1 Pyridine Compounds For The Treatment Of Prostaglandin Mediated Diseases GLAXO GROUP LIMITED (GB) 2010-06-03 US disclosed
US-20100137378-A1 Pyridine Compounds For The Treatment Of Prostaglandin Mediated Diseases GLAXO GROUP LIMITED (GB) 2010-06-03 US disclosed
EP-2053042-A1 Pyridine compounds for the treatment of prostaglandin mediated diseases Glaxo Group Limited (GB) 2009-04-29 EP disclosed
EP-2053042-A1 Pyridine compounds for the treatment of prostaglandin mediated diseases Glaxo Group Limited (GB) 2009-04-29 EP disclosed
US-20090099177-A1 PYRIDYL COMPOUNDS GLAXO GROUP LIMITED (GB) 2009-04-16 US disclosed
US-20090099177-A1 PYRIDYL COMPOUNDS GLAXO GROUP LIMITED (GB) 2009-04-16 US disclosed
US-20090099177-A1 PYRIDYL COMPOUNDS GLAXO GROUP LIMITED (GB) 2009-04-16 US disclosed
EP-1833795-B1 PYRIDINE COMPOUNDS FOR THE TREATMENT OF PROSTAGLANDIN MEDIATED DISEASES GLAXO GROUP LTD (GB) 2009-03-04 EP disclosed
EP-2013181-A1 PYRIDYL COMPOUNDS Glaxo Group Limited (GB) 2009-01-14 EP disclosed
US-20080249138-A1 Pyridine Compounds For The Treatment Of Prostaglandin Mediated Diseases MARTIN PAUL GIBLIN GERARD 2008-10-09 US disclosed
US-20080249138-A1 Pyridine Compounds For The Treatment Of Prostaglandin Mediated Diseases MARTIN PAUL GIBLIN GERARD 2008-10-09 US disclosed
US-20080249138-A1 Pyridine Compounds For The Treatment Of Prostaglandin Mediated Diseases MARTIN PAUL GIBLIN GERARD 2008-10-09 US disclosed
WO-2007128752-A1 PYRIDYL COMPOUNDS GLAXO GROUP LIMITED (GB) 2007-11-15 WO disclosed
WO-2007128752-A1 PYRIDYL COMPOUNDS GLAXO GROUP LIMITED (GB) 2007-11-15 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 (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-20100137378-A1 Pyridine Compounds For The Treatment Of Prostaglandin Mediated Diseases PTGER1, PTGDR, PTGER2 PTGER1 1/4885CYP1A2 241/4885CYP2C9 122/4885
US-20080249138-A1 Pyridine Compounds For The Treatment Of Prostaglandin Mediated Diseases PTGER1, PTGDR, PTGER4 PTGER1 1/4885CYP1A2 140/4885CYP2C9 81/4885
US-20090099177-A1 PYRIDYL COMPOUNDS CYP2C19, CYP4F3, C5 PTGER1 180/4885CYP1A2 24/4885CYP2C9 9/4885

“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.