SCHEMBL2981343

SCHEMBL2981343

COc1ccc(Br)cc1S(=O)(=O)NC(=O)C=Cc1ccc(Cn2cccn2)cc1Cc1ccccc1

nearest known ligand 0.61

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PTGER4 P35408 4/20 0.61
PTGER3 P43115 4/20 0.61
PTGER1 P34995 3/20 0.61
DRD3 P35462 1/20 0.61
KAT7 O95251 9/20 0.42
KAT6A Q92794 9/20 0.42
KAT6B Q8WYB5 7/20 0.42
CYP2C9 P11712 1/20 0.41
CYP2C19 P33261 1/20 0.41
KAT5 Q92993 5/20 0.40
KAT8 Q9H7Z6 5/20 0.40
ALDH1A1 P00352 3/20 0.40
GAA P10253 3/20 0.40
PTGER2 P43116 2/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
USP2 O75604 1/20 0.39
MAPT P10636 1/20 0.39
HTT P42858 1/20 0.39

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
SCHEMBL2981338 1.00 PTGER4 (0.61) PTGER4PTGER3PTGER1DRD3KAT7
SCHEMBL2978833 0.93 PTGER4 (0.73) PTGER4PTGER3PTGER1DRD3KAT7
SCHEMBL2978836 0.93 PTGER4 (0.73) PTGER4PTGER3PTGER1DRD3KAT7
SCHEMBL2971831 0.83 PTGER3 (0.76) PTGER4PTGER3PTGER1DRD3ALDH1A1
SCHEMBL2971837 0.83 PTGER3 (0.76) PTGER4PTGER3PTGER1DRD3ALDH1A1
SCHEMBL2979450 0.77 PTGER3 (0.79) PTGER4PTGER3PTGER1DRD3ALDH1A1
SCHEMBL2979455 0.77 PTGER3 (0.79) PTGER4PTGER3PTGER1DRD3ALDH1A1
SCHEMBL2981238 0.77 PTGER4 (0.54) PTGER4PTGER3PTGER1DRD3CYP2C9
SCHEMBL2979950 0.76 CYP2C9 (0.53) PTGER4PTGER3PTGER1DRD3CYP2C9
SCHEMBL2979949 0.76 CYP2C9 (0.53) PTGER4PTGER3PTGER1DRD3CYP2C9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060258728-A1 Carboxylic acid derivative compounds and drugs comprising these compounds as the active ingredient ONO PHARMACEUTICAL CO., LTD. (JP) 2006-11-16 US claimed
EP-1431267-A1 CARBOXYLIC ACID DERIVATIVE COMPOUNDS AND DRUGS COMPRISING THESE COMPOUNDS AS THE ACTIVE INGREDIENT ONO PHARMACEUTICAL CO., LTD. (JP) 2004-06-23 EP claimed
US-7786161-B2 Carboxylic acid derivatives and pharmaceutical agent comprising the same as active ingredient ONO PHARMACEUTICAL CO., LTD. (JP) 2010-08-31 US disclosed
US-20090318703-A1 CARBOXYLIC ACID DERIVATIVES AND PHARMACEUTICAL AGENT COMPRISING THE SAME AS ACTIVE INGREDIENT ONO PHARMACEUTICAL CO., LTD (JP) 2009-12-24 US disclosed
US-7491748-B2 Carboxylic acid derivative compounds and drugs comprising these compounds as the active ingredient ONO PHARMACEUTICAL CO., LTD. (JP) 2009-02-17 US disclosed
US-20060258728-A1 Carboxylic acid derivative compounds and drugs comprising these compounds as the active ingredient ONO PHARMACEUTICAL CO., LTD. (JP) 2006-11-16 US disclosed
EP-1431267-A1 CARBOXYLIC ACID DERIVATIVE COMPOUNDS AND DRUGS COMPRISING THESE COMPOUNDS AS THE ACTIVE INGREDIENT ONO PHARMACEUTICAL CO., LTD. (JP) 2004-06-23 EP 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-20090318703-A1 CARBOXYLIC ACID DERIVATIVES AND PHARMACEUTICAL AGENT COMPRISING THE SAME AS ACTIVE INGREDIENT PTGER2, PTGER4, PTGER1 PTGER4 2/4885PTGER3 4/4885PTGER1 3/4885
US-20060258728-A1 Carboxylic acid derivative compounds and drugs comprising these compounds as the active ingredient PTGER2, PTGER4, PTGER1 PTGER4 2/4885PTGER3 4/4885PTGER1 3/4885

“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.