Indomethacin

Indomethacin

SCHEMBL3518614

COc1ccc2c(c1)c(CC(=O)O)c(C)n2C(=O)c1ccc(Cl)cc1.COc1ccc2c(c1)c(CC(=O)O)c(C)n2C(=O)c1ccc(Cl)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

PTGS1PTGS2

The experimentally established mechanism targets of Indomethacin. 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 9/20 1.00
PTGS1 known ✓ P23219 4/20 1.00
AKR1C3 P42330 7/20 1.00
AKR1C2 P52895 6/20 1.00
HIF1A Q16665 3/20 1.00
ABCB1 P08183 2/20 1.00
LMNA P02545 2/20 1.00
CYP1A2 P05177 2/20 1.00
CYP2D6 P10635 2/20 1.00
CYP2C9 P11712 2/20 1.00
NPSR1 Q6W5P4 2/20 1.00
GLO1 Q04760 2/20 1.00
AKR1C4 P17516 2/20 1.00
AKR1C1 Q04828 2/20 1.00
KDM4E B2RXH2 1/20 1.00
MEN1 O00255 1/20 1.00
PTGES O14684 1/20 1.00
ABCC3 O15438 1/20 1.00
ABCC4 O15439 1/20 1.00
ABCB11 O95342 1/20 1.00

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
Indomethacin SCHEMBL29525957 1.00 PTGS2 (1.00) PTGS2AKR1C3AKR1C2PTGS1HIF1A
Indomethacin SCHEMBL29353712 1.00 PTGS2 (1.00) PTGS2AKR1C3AKR1C2PTGS1HIF1A
Indomethacin SCHEMBL9300 1.00 PTGS2 (1.00) PTGS2AKR1C3AKR1C2PTGS1HIF1A
Indomethacin SCHEMBL6356562 0.99 PTGS2 (0.98) PTGS2AKR1C3AKR1C2PTGS1HIF1A
Indomethacin SCHEMBL1817813 0.99 PTGS2 (0.98) PTGS2AKR1C3AKR1C2PTGS1HIF1A
Indomethacin SCHEMBL23632959 0.99 PTGS2 (0.98) PTGS2AKR1C3AKR1C2PTGS1HIF1A
Indomethacin SCHEMBL8352438 0.99 PTGS2 (0.98) PTGS2AKR1C3AKR1C2PTGS1HIF1A
Indomethacin SCHEMBL22472310 0.99 PTGS2 (0.98) PTGS2AKR1C3AKR1C2PTGS1HIF1A
Indomethacin SCHEMBL3860125 0.99 PTGS2 (0.98) PTGS2AKR1C3AKR1C2PTGS1HIF1A
Indomethacin SCHEMBL23391006 0.99 PTGS2 (0.98) PTGS2AKR1C3AKR1C2PTGS1HIF1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107970220-A A kind of Indomethacin solid disperses sustained release preparation and preparation method thereof 浙江工业大学 2018-05-01 CN claimed
WO-2007110755-A1 PROPHYLAXIS OR TREATMENT OF CARDIOVASCULAR INFLAMMATION MEDICAL THERAPIES LIMITED (AU) 2007-10-04 WO claimed
WO-2007026240-A1 SUNSCREEN AND COSMETIC COMPOSITIONS FOR PROPHYLAXIS OR TREATMENT OF SKIN CANCERS MEDICAL THERAPIES LIMITED (AU) 2007-03-08 WO claimed
WO-2006099685-A1 METHOD FOR THE PROPHYLAXIS OR TREATMENT OF CARCINOMAS MEDICAL THERAPIES LIMITED (AU) 2006-09-28 WO claimed
CN-108384031-A A kind of preparation method and application of sustained-release hydrogel carrier material 中南民族大学 2018-08-10 CN disclosed
CN-107865822-A A kind of preparation method and application for the pharmaceutical hydrogel slow releasing carrier material for mixing mesoporous nano silicon dioxide 中南民族大学 2018-04-03 CN disclosed
US-20180066004-A9 MITOCHONDRIA-TARGETING PLATINUM(IV) PRODRUG UNIVERSITY OF GEORGIA RESEARCH FOUNDATION, INC. (US) 2018-03-08 US disclosed
CN-105392786-B Flavonoids and application thereof 济州大学校产学协力团 2018-02-16 CN disclosed
US-9745558-B2 VEGFR-3 ligand binding molecules and uses thereof VEGENICS PTY LIMITED (AU) 2017-08-29 US disclosed
US-20170190726-A9 PRODRUG FOR RELEASE OF CISPLATIN AND CYCLOOXYGENASE INHIBITOR THE GOVERNMENT OF THE UNITED STATES, AS REPRESENTED BY THE SECRETARY OF THE ARMY 2017-07-06 US disclosed
US-20170087167-A1 MODIFICATION OF DRUGS FOR INCORPORATION INTO NANOPARTICLES THE GOVERNMENT OF THE UNITED STATES, AS REPRESENTED BY THE SECRETARY OF THE ARMY 2017-03-30 US disclosed
US-20170042898-A1 METHODS AND COMPOSITIONS FOR TREATING VIRAL OR VIRALLY-INDUCED CONDITIONS HEMAQUEST PHARMACEUTICALS, INC. (US) 2017-02-16 US disclosed
US-4350689-A Combinations of agents which give enhanced anti-inflammatory activity AMERICAN CYANAMID COMPANY (US) 1982-09-21 US disclosed
US-4325949-A ACETOXYBENZOIC ACID/O- AMERICAN CYANAMID COMPANY (US) 1982-04-20 US disclosed
US-4292319-A MIXTURE WITH AN ANTIULCER AGENT BOEHRINGER INGELHEIM GMBH (DE) 1981-09-29 US disclosed
US-4256747-A ANTIINFLAMMATORY AGENTS, PYRIDO/2,3B//1,4/BENZODIAZEPIN-6-ONES BOEHRINGER INGELHEIM GMBH (DE) 1981-03-17 US disclosed
US-4230717-A METIAMIDE OR CEMETIDINE LOVELACE ALAN M ADMINISTRATOR 1980-10-28 US disclosed
US-4228161-A INDOMETHACIN AND A SUBSTITUTED PHENYL BENZOIC ACID MERCK & CO., INC. (US) 1980-10-14 US disclosed
US-4154833-A INDOMETHACIN (1-(4-CHLOROBENZOYL)-5-METHOXY-2-METHYL-1H-INDOLE-3-ACETIC ACID) WITH PIRENZEPINE (5,11-DIHYDRO-11-((4-METHYL-1-PIPERAZINYL)-ACETYL)-6H-PYRIDO(2,3 -B)(1,4)BENZODIAZEPIN-6-ONE) BOEHRINGER INGELHEIM GMBH (DE) 1979-05-15 US disclosed
US-4136194-A ANTIINFLAMMATORY SPOFA, UNITED PHARMACEUTICAL WORKS (CS) 1979-01-23 US 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 (3 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-20170190726-A9 PRODRUG FOR RELEASE OF CISPLATIN AND CYCLOOXYGENASE INHIBITOR PTGS1, PTGES, PTGIS PTGS2 5/4885PTGS1 1/4885AKR1C3 1333/4885
US-20180066004-A9 MITOCHONDRIA-TARGETING PLATINUM(IV) PRODRUG MT-ND4, MT-CO3, COX6A1 PTGS2 602/4885PTGS1 661/4885AKR1C3 2874/4885
US-20170087167-A1 MODIFICATION OF DRUGS FOR INCORPORATION INTO NANOPARTICLES NLN, PRNP, TPMT PTGS2 38/4885PTGS1 17/4885AKR1C3 2603/4885

“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.