Mesalamine

Mesalamine

SCHEMBL6517036

Cl.Nc1ccc(O)c(C(=O)O)c1

nearest known ligand 0.96

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ALOX5PPARGPTGS1PTGS2

The experimentally established mechanism targets of Mesalamine. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGS2 known ✓ P35354 2/20 0.96
ALOX5 known ✓ P09917 2/20 0.59
MEN1 O00255 4/20 0.96
KMT2A Q03164 4/20 0.96
KDM4E B2RXH2 4/20 0.96
ALDH1A1 P00352 4/20 0.96
TDP1 Q9NUW8 4/20 0.96
HPGD P15428 3/20 0.96
HSD17B10 Q99714 3/20 0.96
CYP3A4 P08684 2/20 0.96
THRB P10828 2/20 0.96
RECQL P46063 2/20 0.96
KDR P35968 2/20 0.96
CYP2C9 P11712 2/20 0.96
CYP2C19 P33261 2/20 0.96
TNF P01375 1/20 0.96
HSPD1 P10809 1/20 0.96
ALOX15 P16050 1/20 0.96
CASP1 P29466 1/20 0.96
BRCA1 P38398 1/20 0.96

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
Mesalamine SCHEMBL1967328 0.98 KDM4E (1.00) MEN1KMT2AKDM4EALDH1A1TDP1
Mesalamine SCHEMBL28077836 0.98 KDM4E (1.00) MEN1KMT2AKDM4EALDH1A1TDP1
Mesalamine SCHEMBL31297 0.98 KDM4E (1.00) MEN1KMT2AKDM4EALDH1A1TDP1
Mesalamine SCHEMBL29354798 0.98 KDM4E (1.00) MEN1KMT2AKDM4EALDH1A1TDP1
Mesalamine SCHEMBL10493008 0.96 KDM4E (0.96) MEN1KMT2AKDM4EALDH1A1TDP1
Mesalamine SCHEMBL15329203 0.96 KDM4E (0.96) MEN1KMT2AKDM4EALDH1A1TDP1
Mesalamine SCHEMBL2680203 0.96 KDM4E (0.96) MEN1KMT2AKDM4EALDH1A1TDP1
Mesalamine SCHEMBL9688231 0.96 KDM4E (0.96) MEN1KMT2AKDM4EALDH1A1TDP1
Mesalamine SCHEMBL2679950 0.96 KDM4E (0.96) MEN1KMT2AKDM4EALDH1A1TDP1
Mesalamine SCHEMBL2680533 0.96 KDM4E (0.96) MEN1KMT2AKDM4EALDH1A1TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3044203-B1 PROCESS FOR THE PRODUCTION OF HIGH-DENSITY MESALAMINE ERREGIERRE SPA (IT) 2018-09-05 EP claimed
EP-3044203-A1 PROCESS FOR THE PRODUCTION OF HIGH-DENSITY MESALAMINE ERREGIERRE S.p.A. (IT) 2016-07-20 EP claimed
WO-2015036920-A1 PROCESS FOR THE PRODUCTION OF HIGH-DENSITY MESALAMINE ERREGIERRE S.P.A. (IT) 2015-03-19 WO claimed
WO-2012090224-A1 NOVEL COCRYSTALS / MOLECULAR SALTS OF MESALAMINE TO BE USED AS IMPROVED ANTI-INFLAMMATORY DRUG NUTRACRYST THERAPEUTICS PRIVATE LIMITED (IN) 2012-07-05 WO claimed
JP-2023890-A None JP disclosed
CN-118239854-A Mesalamine-palmatine hydrochloride pharmaceutical co-crystal and preparation method and application thereof 福州大学 2024-06-25 CN disclosed
CN-118184529-A Preparation method of low-chloride mesalazine 浙江恒康药业股份有限公司 2024-06-14 CN disclosed
CN-118184529-A Preparation method of low-chloride mesalazine 浙江恒康药业股份有限公司 2024-06-14 CN disclosed
CN-112272557-B System for moulding and coating pharmaceutical tablets 康蒂纽斯制药公司 2023-11-03 CN disclosed
CN-111662281-B Salicylic acid berberine type alkaloid quaternary ammonium salt and application thereof in preparing medicines 中国医学科学院药物研究所 2023-01-06 CN disclosed
CN-111662281-A Salicylic acid berberine type alkaloid quaternary ammonium salt and application thereof in preparing medicines 中国医学科学院药物研究所 2020-09-15 CN disclosed
US-20180263940-A1 TREATMENT OF SKIN CONDITIONS MONASH UNIVERSITY (AU) 2018-09-20 US disclosed
US-4650753-A Novel substrates for use in measuring the concentration of kallikrein in urine NITTO BOSEKI CO., LTD. (JP) 1987-03-17 US disclosed
US-4622389-A Novel substrate for determining the activity of blood coagulation factor Xa (Stuart-Prower factor) Nitto Poseki Co., Ltd. (JP) 1986-11-11 US disclosed
EP-0170797-A1 Novel substrate for determining the activity of blood coagulation factor Xa (Stuart-Prower Factor) NITTO BOSEKI CO., LTD. (JP) 1986-02-12 EP disclosed
EP-0167980-A2 Novel substrates for use in measuring the concentration of kallikrein in urine NITTO BOSEKI CO., LTD. (JP) 1986-01-15 EP disclosed
EP-0094789-B1 NOVEL METHOD FOR DETERMINATION OF 5-AMINOSALICYLIC ACID NITTO BOSEKI CO., LTD. (JP) 1985-08-28 EP disclosed
US-4529709-A Colorimetric analysis using o-alkylphenol and a 5-aminosalicylic acid NITTO BOSEKI CO. LTD. (JP) 1985-07-16 US disclosed
EP-0094789-A1 Novel method for determination of 5-aminosalicylic acid NITTO BOSEKI CO., LTD. (JP) 1983-11-23 EP disclosed
JP-H00223890-A 0001-01-01 JP 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-20180263940-A1 TREATMENT OF SKIN CONDITIONS ASAH2, ASAH1, ACER2 PTGS2 689/4885ALOX5 41/4885MEN1 3718/4885

“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.