SCHEMBL6605588

SCHEMBL6605588

COc1ccc(-c2sccc2-c2cc(Cl)ccc2OCc2ccccc2)cc1C(=O)O

nearest known ligand 0.71

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PTGER1 P34995 19/20 0.71
TBXA2R P21731 10/20 0.71
MRGPRX4 Q96LA9 1/20 0.53
CYP2C9 P11712 1/20 0.51

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
SCHEMBL6607313 0.90 PTGER1 (0.74) PTGER1TBXA2RMRGPRX4CYP2C9
SCHEMBL6609635 0.89 PTGER1 (0.71) PTGER1TBXA2RCYP2C9
SCHEMBL6605099 0.85 PTGER1 (0.81) PTGER1TBXA2RMRGPRX4CYP2C9
SCHEMBL6245317 0.83 PTGER1 (1.00) PTGER1TBXA2RCYP2C9
SCHEMBL6604857 0.81 PTGER1 (1.00) PTGER1TBXA2RCYP2C9
SCHEMBL4446350 0.81 PTGER1 (0.74) PTGER1TBXA2RMRGPRX4CYP2C9
SCHEMBL6605261 0.80 PTGER1 (0.85) PTGER1TBXA2RCYP2C9
SCHEMBL5100875 0.80 PTGER1 (1.00) PTGER1TBXA2RCYP2C9
SCHEMBL4448139 0.78 PTGER1 (0.90) PTGER1TBXA2RMRGPRX4CYP2C9
SCHEMBL6606755 0.78 PTGER1 (0.72) PTGER1TBXA2RMRGPRX4CYP2C9

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 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1216238-B1 CARBOXYLIC ACIDS AND ACYLSULFONAMIDES, COMPOSITIONS CONTAINING SUCH COMPOUNDS AND METHODS OF TREATMENT MERCK FROSST CANADA INC (CA) 2004-02-18 EP claimed
EP-1216238-A2 CARBOXYLIC ACIDS AND ACYLSULFONAMIDES, COMPOSITIONS CONTAINING SUCH COMPOUNDS AND METHODS OF TREATMENT Merck Frosst Canada & Co. (CA) 2002-06-26 EP claimed
US-6369084-B1 PROSTAGLANDIN MEDIATED DISEASES MERCK FROSST CANADA & CO. (CA) 2002-04-09 US claimed
WO-2001019814-A2 CARBOXYLIC ACIDS AND ACYLSULFONAMIDES, COMPOSITIONS CONTAINING SUCH COMPOUNDS AND METHODS OF TREATMENT MERCK FROSST CANADA & CO. (CA) 2001-03-22 WO claimed
EP-1216238-B1 CARBOXYLIC ACIDS AND ACYLSULFONAMIDES, COMPOSITIONS CONTAINING SUCH COMPOUNDS AND METHODS OF TREATMENT MERCK FROSST CANADA INC (CA) 2004-02-18 EP disclosed
US-20020137746-A1 Method of treating or preventing urinary incontinence using prostanoid EP1 receptor antagonists CARL FRANCOIS JOSEPH (CA) 2002-09-26 US disclosed
EP-1216238-A2 CARBOXYLIC ACIDS AND ACYLSULFONAMIDES, COMPOSITIONS CONTAINING SUCH COMPOUNDS AND METHODS OF TREATMENT Merck Frosst Canada & Co. (CA) 2002-06-26 EP disclosed
US-6369084-B1 PROSTAGLANDIN MEDIATED DISEASES MERCK FROSST CANADA & CO. (CA) 2002-04-09 US disclosed
WO-2001019814-A2 CARBOXYLIC ACIDS AND ACYLSULFONAMIDES, COMPOSITIONS CONTAINING SUCH COMPOUNDS AND METHODS OF TREATMENT MERCK FROSST CANADA & CO. (CA) 2001-03-22 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 (1 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-20020137746-A1 Method of treating or preventing urinary incontinence using prostanoid EP1 receptor antagonists PTGER1, PTGIR, PTGS1 PTGER1 1/4885TBXA2R 20/4885MRGPRX4 264/4885

“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.