SCHEMBL2956473

SCHEMBL2956473

O=C(O)c1cccc(Cc2cc(Cl)ccc2O)n1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGER1 P34995 11/20 0.62
MRGPRX4 Q96LA9 4/20 0.55
MEN1 O00255 2/20 0.53
CYP3A4 P08684 2/20 0.53
HPGD P15428 2/20 0.53
ALOX15 P16050 2/20 0.53
KMT2A Q03164 2/20 0.53
HIF1A Q16665 2/20 0.53
SLC22A1 O15245 1/20 0.53
USP2 O75604 1/20 0.53
LMNA P02545 1/20 0.53
HSP90AA1 P07900 1/20 0.53
MAPT P10636 1/20 0.53
HSPD1 P10809 1/20 0.53
HSPA5 P11021 1/20 0.53
IDO1 P14902 1/20 0.53
ALOX12 P18054 1/20 0.53
CASP1 P29466 1/20 0.53
HTT P42858 1/20 0.53
BLM P54132 1/20 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
SCHEMBL13902814 0.84 PTGER1 (0.50) PTGER1MEN1CYP3A4HPGDALOX15
SCHEMBL25113757 0.83 PTGER1 (0.63) PTGER1MRGPRX4CYP1A2CYP2C9TBXA2R
SCHEMBL2955012 0.82 CYP1A2 (0.55) PTGER1MRGPRX4MEN1CYP3A4HPGD
SCHEMBL13902805 0.80 PTGER1 (0.60) PTGER1MRGPRX4CYP1A2CYP2C9TBXA2R
SCHEMBL13902810 0.80 PTGER1 (0.60) PTGER1MRGPRX4CYP1A2CYP2C9TBXA2R
Acetone SCHEMBL27709152 0.80 CYP1A2 (0.52) PTGER1MRGPRX4MAPTCYP1A2CYP2C9
SCHEMBL2954536 0.79 PTGER1 (0.70) PTGER1MRGPRX4CYP1A2CYP2C9TBXA2R
SCHEMBL13239372 0.78 PTGER1 (0.76) PTGER1MRGPRX4CYP1A2CYP2C9TBXA2R
SCHEMBL2352264 0.78 KDM4E (0.67) PTGER1MRGPRX4ALOX15
SCHEMBL13239359 0.77 PTGER1 (0.91) PTGER1MRGPRX4CYP1A2CYP2C9TBXA2R

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 8 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-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-1833795-B1 PYRIDINE COMPOUNDS FOR THE TREATMENT OF PROSTAGLANDIN MEDIATED DISEASES GLAXO GROUP LTD (GB) 2009-03-04 EP disclosed
EP-1833795-B1 PYRIDINE COMPOUNDS FOR THE TREATMENT OF PROSTAGLANDIN MEDIATED DISEASES GLAXO GROUP LTD (GB) 2009-03-04 EP disclosed
US-20080249138-A1 Pyridine Compounds For The Treatment Of Prostaglandin Mediated Diseases MARTIN PAUL GIBLIN GERARD 2008-10-09 US disclosed
EP-1833795-A1 PYRIDINE COMPOUNDS FOR THE TREATMENT OF PROSTAGLANDIN MEDIATED DISEASES GLAXO GROUP LIMITED (GB) 2007-09-19 EP disclosed
WO-2006066968-A1 PYRIDINE COMPOUNDS FOR THE TREATMENT OF PROSTAGLANDIN MEDIATED DISEASES GLAXO GROUP LIMITED (GB) 2006-06-29 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-20100137378-A1 Pyridine Compounds For The Treatment Of Prostaglandin Mediated Diseases PTGER1, PTGDR, PTGER2 PTGER1 1/4885MRGPRX4 25/4885MEN1 2236/4885
US-20080249138-A1 Pyridine Compounds For The Treatment Of Prostaglandin Mediated Diseases PTGER1, PTGDR, PTGER4 PTGER1 1/4885MRGPRX4 32/4885MEN1 1930/4885

“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.