SCHEMBL730472

SCHEMBL730472

Cc1ccc(S(=O)(=O)OC[C@@H]2CN(C)c3ccccc3O2)cc1

nearest known ligand 0.46

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PTGIR P43119 7/20 0.46
LMNA P02545 4/20 0.46
ALDH1A1 P00352 2/20 0.44
CYP3A4 P08684 2/20 0.44
CYP2D6 P10635 2/20 0.44
TSHR P16473 2/20 0.44
CYP2C9 P11712 1/20 0.44
CYP2C19 P33261 1/20 0.44
MAPT P10636 1/20 0.44
MAPK1 P28482 1/20 0.44
SMN1; SMN2 Q16637 2/20 0.43
P2RX4 Q99571 1/20 0.42
CA2 P00918 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
SCHEMBL6979029 0.86 LMNA (0.43) PTGIRLMNAALDH1A1CYP3A4CYP2D6
SCHEMBL9699072 0.86 LMNA (0.44) LMNAALDH1A1CYP3A4CYP2D6TSHR
SCHEMBL6978072 0.86 LMNA (0.44) LMNAALDH1A1CYP3A4CYP2D6TSHR
SCHEMBL6978928 0.86 LMNA (0.44) PTGIRLMNAALDH1A1CYP3A4CYP2D6
SCHEMBL6979329 0.85 ALDH1A1 (0.41) PTGIRALDH1A1CYP3A4CYP2D6TSHR
SCHEMBL6967825 0.85 GRM2 (0.54) LMNAALDH1A1CYP3A4CYP2D6TSHR
SCHEMBL12695869 0.84 MAPT (0.48) LMNAALDH1A1CYP3A4CYP2D6TSHR
SCHEMBL5100424 0.83 PTGIR (0.46) PTGIRCA2
SCHEMBL2190445 0.83 PTGIR (0.46) PTGIRCA2
SCHEMBL3208378 0.83 CYP2D6 (0.45) PTGIRLMNAALDH1A1CYP3A4CYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2177513-B1 PHENYLACETIC ACID COMPOUND ONO PHARMACEUTICAL CO (JP) 2015-07-01 EP disclosed
US-20140357630-A1 Phenylacetic Acid Compound ONO PHARMACEUTICAL CO., LTD. (JP) 2014-12-04 US disclosed
US-20140357630-A1 Phenylacetic Acid Compound ONO PHARMACEUTICAL CO., LTD. (JP) 2014-12-04 US disclosed
US-8809524-B2 Phenylacetic acid compound ONO PHARMACEUTICAL CO., LTD. (JP) 2014-08-19 US disclosed
US-8809524-B2 Phenylacetic acid compound ONO PHARMACEUTICAL CO., LTD. (JP) 2014-08-19 US disclosed
US-20130225808-A1 PHENYLACETIC ACID COMPOUND ONO PHARMACEUTICAL CO., LTD. (JP) 2013-08-29 US disclosed
US-20130225808-A1 PHENYLACETIC ACID COMPOUND ONO PHARMACEUTICAL CO., LTD. (JP) 2013-08-29 US disclosed
US-8476266-B2 Phenylacetic acid compound ONO PHARMACEUTICAL CO., LTD. (JP) 2013-07-02 US disclosed
US-20130028887-A1 PHENYLACETIC ACID COMPOUND ONO PHARMACEUTICAL CO., LTD. (JP) 2013-01-31 US disclosed
EP-1666473-B1 CARBOXYLIC ACID COMPOUNDS AND MEDICINAL COMPOSITIONS CONTAINING THE SAME AS THE ACTIVE INGREDIENT ONO PHARMACEUTICAL CO (JP) 2013-01-02 EP disclosed
EP-2177513-A1 PHENYLACETIC ACID COMPOUND ONO Pharmaceutical Co., Ltd. (JP) 2010-04-21 EP disclosed
EP-2177513-A1 PHENYLACETIC ACID COMPOUND ONO Pharmaceutical Co., Ltd. (JP) 2010-04-21 EP disclosed
US-20100029631-A1 CARBOXYLIC ACID COMPOUNDS AND MEDICINAL COMPOSITIONS CONTAINING THE SAME AS THE ACTIVE INGREDIENT ONO PHARMACEUTICAL CO., LTD. (JP) 2010-02-04 US disclosed
US-7601712-B2 Such as (1)-2-(4-chloro-3-((2-chloro-4-(((2S)-4-methyl-3,4-dihydro-2H-1,4-benzoxazin-2-ly)methoxy)benzoyl)amino)phenyl)-2-methylpropanoic acid; prostaglandin receptor agonists ONO PHARMACEUTICAL CO., LTD. (JP) 2009-10-13 US disclosed
US-7351705-B2 Carboxylic acid compounds and a pharmaceutical agent comprising the compound as the active ingredient ONO PHARMACEUTICAL CO., LTD. (JP) 2008-04-01 US disclosed
US-20070004716-A1 Carboxylic acid compounds and medicinal compositions containing the same as the active ingredient ONO PHARMACEUTICAL CO., LTD. (JP) 2007-01-04 US disclosed
EP-1666473-A1 CARBOXYLIC ACID COMPOUNDS AND MEDICINAL COMPOSITIONS CONTAINING THE SAME AS THE ACTIVE INGREDIENT ONO PHARMACEUTICAL CO., LTD. (JP) 2006-06-07 EP disclosed
US-20060089353-A1 Indole derivative compounds and drugs containing the compounds as the active ingredient ONO PHARMACEUTICAL CO., LTD. (JP) 2006-04-27 US disclosed
US-20050222216-A1 Carboxyoic acid compounds and drugs containing the compounds as the active ingredient ONO PHARMACEUTICAL CO., LTD. (JP) 2005-10-06 US disclosed
EP-1486491-A1 CARBOXYOIC ACID COMPOUNDS AND DRUGS CONTAINING THE COMPOUNDS AS THE ACTIVE INGREDIENT ONO PHARMACEUTICAL CO., LTD. (JP) 2004-12-15 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 (7 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-20130225808-A1 PHENYLACETIC ACID COMPOUND PC, PAH, PDHA2 PTGIR 3123/4885LMNA 2910/4885ALDH1A1 64/4885
US-20060089353-A1 Indole derivative compounds and drugs containing the compounds as the active ingredient PTGIS, IDO1, IDO2 PTGIR 4/4885LMNA 4422/4885ALDH1A1 1468/4885
US-20100029631-A1 CARBOXYLIC ACID COMPOUNDS AND MEDICINAL COMPOSITIONS CONTAINING THE SAME AS THE ACTIVE INGREDIENT GPR17, CYSLTR1, KIT PTGIR 6/4885LMNA 4266/4885ALDH1A1 368/4885
US-20130028887-A1 PHENYLACETIC ACID COMPOUND PC, PAH, PDHA2 PTGIR 3123/4885LMNA 2910/4885ALDH1A1 64/4885
US-20070004716-A1 Carboxylic acid compounds and medicinal compositions containing the same as the active ingredient GPR17, CYSLTR1, KIT PTGIR 6/4885LMNA 4266/4885ALDH1A1 368/4885
US-20050222216-A1 Carboxyoic acid compounds and drugs containing the compounds as the active ingredient UACA, CPA3, HCAR1 PTGIR 30/4885LMNA 4217/4885ALDH1A1 588/4885
US-20140357630-A1 Phenylacetic Acid Compound PC, PAH, PDHA2 PTGIR 3123/4885LMNA 2910/4885ALDH1A1 64/4885

“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.