Aspirin

Aspirin

SCHEMBL24830

CC(=O)Oc1ccccc1C(=O)[O-].CC(=O)Oc1ccccc1C(=O)[O-].[Al+2]

nearest known ligand 0.67

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

PTGS1PTGS2

The experimentally established mechanism targets of Aspirin. 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 5/20 0.67
PTGS1 known ✓ P23219 1/20 0.67
KDM4E B2RXH2 5/20 0.67
HSD17B10 Q99714 4/20 0.67
HPGD P15428 4/20 0.67
ALDH1A1 P00352 2/20 0.67
ESR1 P03372 1/20 0.67
ITGB3 P05106 1/20 0.67
ITGA2B P08514 1/20 0.67
HMGB1 P09429 1/20 0.67
TSHR P16473 1/20 0.67
GGT1 P19440 1/20 0.67
BLM P54132 1/20 0.67
NAPRT Q6XQN6 1/20 0.67
TDP1 Q9NUW8 1/20 0.67
LMNA P02545 1/20 0.59
CYP1A2 P05177 1/20 0.59
CYP2C9 P11712 1/20 0.59
MAPK1 P28482 1/20 0.51
MEN1 O00255 1/20 0.48

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
Aspirin SCHEMBL29382620 1.00 KDM4E (0.67) KDM4EPTGS2HSD17B10HPGDALDH1A1
Aspirin SCHEMBL26228 0.96 KDM4E (0.67) KDM4EPTGS2HSD17B10HPGDALDH1A1
Aspirin SCHEMBL1939134 0.96 KDM4E (0.67) KDM4EPTGS2HSD17B10HPGDALDH1A1
Aspirin SCHEMBL1457620 0.96 KDM4E (0.67) KDM4EPTGS2HSD17B10HPGDALDH1A1
Aspirin SCHEMBL191054 0.96 KDM4E (0.67) KDM4EPTGS2HSD17B10HPGDALDH1A1
Aspirin SCHEMBL4534925 0.96 KDM4E (0.67) KDM4EPTGS2HSD17B10HPGDALDH1A1
Aspirin SCHEMBL7250097 0.96 KDM4E (0.67) KDM4EPTGS2HSD17B10HPGDALDH1A1
Aspirin SCHEMBL21328428 0.96 KDM4E (0.67) KDM4EPTGS2HSD17B10HPGDALDH1A1
Aspirin SCHEMBL162391 0.96 KDM4E (0.67) KDM4EPTGS2HSD17B10HPGDALDH1A1
Aspirin SCHEMBL3677210 0.96 KDM4E (0.67) KDM4EPTGS2HSD17B10HPGDALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2021054927-A2 GLUTATHIONE-CHOLESTEROL DERIVATIVES AS BRAIN TARGETING AGENTS SOUTH DAKOTA BOARD OF REGENTS (US) 2021-03-25 WO claimed
US-20200048305-A1 GLUTATHIONE-CHOLESTEROL DERIVATIVES AS BRAIN TARGETING AGENTS SOUTH DAKOTA BOARD OF REGENTS (US) 2020-02-13 US claimed
US-9622969-B2 Polymer conjugated protein micelles SOUTH DAKOTA STATE UNIV (US) 2017-04-18 US claimed
US-20140370110-A1 POLYMER CONJUGATED PROTEIN MICELLES SOUTH DAKOTA STATE UNIVERSITY (US) 2014-12-18 US claimed
US-20090312433-A1 TREATMENT OF VR1-ANTAGONIST-INDUCED INCREASE IN BODY TEMPERATURE WITH AN ANTIPYRETIC AGENT AMGEN INC. 2009-12-17 US claimed
EP-1617816-B1 NANOPARTICULATE MELOXICAN FORMULATIONS ELAN PHARMA INT LTD (IE) 2009-05-13 EP claimed
EP-1938803-A2 Formulations comprising nanoparticulate meloxican Elan Pharma International Limited (IE) 2008-07-02 EP claimed
EP-1885348-A2 ANTIPYRETIC AGENTS AGAINST VR1-ANTAGONIST-INDUCED INCREASES IN BODY TEMPERATURE Amgen, Inc (US) 2008-02-13 EP claimed
US-20060281718-A1 Treatment of VR1-antagonist-induced increase in body temperature with an antipyretic agent AMGEN INC. 2006-12-14 US claimed
EP-1480624-B1 PHARMACEUTICAL TABLET PHARMACIA CORP (US) 2006-11-29 EP claimed
US-20040214753-A1 Dispersible pharmaceutical composition for treatment of mastitis and otic disorders PHARMACIA & UPJOHN COMPANY 2004-10-28 US claimed
WO-2004082719-A1 DISPERSIBLE PHARMACEUTICAL COMPOSITION FOR TREATMENT OF MASTITIS AND OTIC DISORDERS PHARMACIA CORPORATION (US) 2004-09-30 WO claimed
WO-2004082588-A2 DISPERSIBLE FORMULATION OF AN ANTI-INFLAMMATORY AGENT PHARMACIA CORPORATION (US) 2004-09-30 WO claimed
US-20040156872-A1 Novel nimesulide compositions ELAN PHARMA INTERNATIONAL LTD. 2004-08-12 US claimed
US-20030235617-A1 Pharmaceutical dosage form for mucosal delivery MCNEIL-PPC, INC 2003-12-25 US claimed
US-20030180357-A1 Pharmaceutical tablet MCNEIL-PPC, INC 2003-09-25 US claimed
US-5731277-A Automatic dishwashing compositions containing aluminum tetrahydroxide LEVER BROTHERS COMPANY, DIVISION OF CONOPCO, INC. (US) 1998-03-24 US claimed
EP-0826024-A1 AUTOMATIC DISHWASHING COMPOSITIONS CONTAINING ALUMINUM SALTS UNILEVER N.V. (NL) 1998-03-04 EP claimed
US-5698506-A Automatic dishwashing compositions containing aluminum salts LEVER BROTHERS COMPANY, DIVISION OF CONOPCO, INC. (US) 1997-12-16 US claimed
WO-1996036687-A1 AUTOMATIC DISHWASHING COMPOSITIONS CONTAINING ALUMINUM SALTS UNILEVER N.V. (NL) 1996-11-21 WO claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (8 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-20040156872-A1 Novel nimesulide compositions NIM1K, NIT2, NCL PTGS2 2387/4885PTGS1 1780/4885KDM4E 1888/4885
US-20030180357-A1 Pharmaceutical tablet GYPA, SORD, SRI PTGS2 593/4885PTGS1 155/4885KDM4E 3204/4885
US-20200048305-A1 GLUTATHIONE-CHOLESTEROL DERIVATIVES AS BRAIN TARGETING AGENTS GSTK1, GSTO1, GSTM2 PTGS2 285/4885PTGS1 333/4885KDM4E 4520/4885
US-20090312433-A1 TREATMENT OF VR1-ANTAGONIST-INDUCED INCREASE IN BODY TEMPERATURE WITH AN ANTIPYRETIC AGENT VRK1, VIPR1, AVPR1A PTGS2 777/4885PTGS1 247/4885KDM4E 4666/4885
US-20140370110-A1 POLYMER CONJUGATED PROTEIN MICELLES MTDH, PSMG3, GHITM PTGS2 2644/4885PTGS1 2339/4885KDM4E 3234/4885
US-20030235617-A1 Pharmaceutical dosage form for mucosal delivery SI, UGGT1, GYPA PTGS2 557/4885PTGS1 196/4885KDM4E 2862/4885
US-20060281718-A1 Treatment of VR1-antagonist-induced increase in body temperature with an antipyretic agent VRK1, VIPR1, AVPR1A PTGS2 777/4885PTGS1 247/4885KDM4E 4666/4885
US-20040214753-A1 Dispersible pharmaceutical composition for treatment of mastitis and otic disorders OTC, AQP3, AQP1 PTGS2 418/4885PTGS1 422/4885KDM4E 4856/4885

“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.