SCHEMBL12286244

SCHEMBL12286244

CC(=O)C1CCn2c(C(=O)c3ccccc3)ccc21

nearest known ligand 0.79

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 4/20 0.79
CDC42 P60953 3/20 0.79
RAC1 P63000 3/20 0.79
PTGS1 P23219 2/20 0.79
PAK1 Q13153 2/20 0.79
NPC1 O15118 2/20 0.79
RAB9A P51151 2/20 0.79
CHRM3 P20309 1/20 0.79
OPRM1 P35372 1/20 0.79
LMNA P02545 2/20 0.64
ABCC4 O15439 1/20 0.64
HTT P42858 1/20 0.64
BLM P54132 1/20 0.64
CYP1A2 P05177 1/20 0.64
NFKB1 P19838 1/20 0.64
MAPK1 P28482 1/20 0.64
CA4 P22748 5/20 0.57
CA9 Q16790 4/20 0.57
CA12 O43570 3/20 0.57
CA1 P00915 3/20 0.57

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
Ketorolac SCHEMBL2221913 0.90 PTGS2 (0.92) PTGS2CDC42RAC1PTGS1PAK1
SCHEMBL24807886 0.89 PTGS2 (0.75) PTGS2CDC42RAC1PTGS1PAK1
Ketorolac SCHEMBL14892 0.88 PTGS2 (1.00) PTGS2CDC42RAC1PTGS1PAK1
Ketorolac SCHEMBL14891 0.88 PTGS2 (1.00) PTGS2CDC42RAC1PTGS1PAK1
Ketorolac SCHEMBL23466702 0.88 PTGS2 (1.00) PTGS2CDC42RAC1PTGS1PAK1
Ketorolac SCHEMBL4103 0.88 PTGS2 (1.00) PTGS2CDC42RAC1PTGS1PAK1
Ketorolac SCHEMBL5301763 0.87 PTGS2 (0.97) PTGS2CDC42RAC1PTGS1PAK1
Ketorolac SCHEMBL20553125 0.87 PTGS2 (0.97) PTGS2CDC42RAC1PTGS1PAK1
Ketorolac SCHEMBL18797655 0.87 PTGS2 (0.97) PTGS2CDC42RAC1PTGS1PAK1
Ketorolac SCHEMBL28826490 0.87 PTGS2 (0.97) PTGS2CDC42RAC1PTGS1PAK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240016799-A1 ANTI-INFLAMMATORY, ANTI-CANCER, AND ANTI-ANGIOGENIC COMPOUNDS, PHARMACEUTICAL COMPOSITIONS, AND METHODS OF MAKING AND USING THEREOF MEDICON PHARMACEUTICALS, INC. 2024-01-18 US disclosed
EP-4272761-A2 COMPOSITIONS FOR TREATING OPHTHALMIC CONDITIONS Medicon Pharmaceuticals, Inc. (US) 2023-11-08 EP disclosed
US-20230293557-A1 COMPOSITIONS AND METHODS FOR TREATING OPHTHALMIC CONDITIONS MEDICON PHARMACEUTICALS INC (US) 2023-09-21 US disclosed
US-20230293557-A1 COMPOSITIONS AND METHODS FOR TREATING OPHTHALMIC CONDITIONS MEDICON PHARMACEUTICALS INC (US) 2023-09-21 US disclosed
US-11752146-B2 Anti-inflammatory, anti-cancer, and anti-angiogenic compounds, pharmaceutical compositions, and methods of making and using thereof MEDICON PHARMACEUTICALS, INC. (US) 2023-09-12 US disclosed
EP-4238571-A1 APPLICATION OF THYMIDINE DERIVATIVE IN PREPARATION OF DRUGS OnQuality Pharmaceuticals China Ltd. (CN) 2023-09-06 EP disclosed
US-20230157952-A1 METHOD FOR IMPROVING THE STABILITY OF A PHARMACEUTICAL COMPOSITION COMPRISING A HIGH PENETRATION DRUG, AND THE PHARMACEUTICAL COMPOSITION OBTAINED THEREFROM TECHFIELDS INC. (US) 2023-05-25 US disclosed
EP-3818981-A1 SYNERGIC PHARMACEUTICAL COMPOSITION OF THE ACTIVE ENANTIOMER (S)-KETOROLAC AND GABAPENTIN FOR THE TREATMENT OF NEUROPATHIC PAIN Amézcua Amézcua, Federico (MX) 2021-05-12 EP disclosed
US-20200246330-A1 ANTI-INFLAMMATORY, ANTI-CANCER, AND ANTI-ANGIOGENIC COMPOUNDS, PHARMACEUTICAL COMPOSITIONS, AND METHODS OF MAKING AND USING THEREOF MEDICON PHARMACEUTICALS, INC. (US) 2020-08-06 US disclosed
WO-2018115984-A1 COMPOSITIONS AND METHODS FOR THE TREATMENT OF INFLAMMATION CELLIX BIO PRIVATE LIMITED (IN) 2018-06-28 WO disclosed
US-8569335-B2 Compounds derived from taurine, process of their preparation and pharmaceutical compositions containing these EMS S.A. (BR) 2013-10-29 US disclosed
US-20130137765-A1 USE OF NITROOXYDERIVATIVE OF DRUG FOR THE TREATMENT OF MUSCULAR DYSTROPHIES NICOX S.A. (FR) 2013-05-30 US disclosed
US-8026285-B2 Control release of biologically active compounds from multi-armed oligomers BEZWADA BIOMEDICAL, LLC (US) 2011-09-27 US disclosed
US-20110118303-A1 NOVEL COMPOUNDS DERIVED FROM TAURINE, PROCESS OF THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THESE EMS S.A. (BR) 2011-05-19 US disclosed
US-20110118303-A1 NOVEL COMPOUNDS DERIVED FROM TAURINE, PROCESS OF THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THESE EMS S.A. (BR) 2011-05-19 US disclosed
WO-2009124371-A9 NOVEL COMPOUNDS DERIVED FROM TAURINE, PROCESS OF THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THESE EMS S. A. (BR) 2010-12-02 WO disclosed
WO-2009124371-A2 NOVEL COMPOUNDS DERIVED FROM TAURINE, PROCESS OF THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THESE EMS S. A. (BR) 2009-10-15 WO disclosed
US-20090093510-A1 Use of Nitrooxyderivatives of Drug for the Treatment of Muscular Dystrophies NICOX SA (FR) 2009-04-09 US disclosed
US-20090076174-A1 CONTROL RELEASE OF BIOLOGICALLY ACTIVE COMPOUNDS FROM MULTI-ARMED OLIGOMERS BEZWADA BIOMEDICAL, LLC (US) 2009-03-19 US disclosed
WO-2007088123-A2 USE OF NITROOXYDERIVATIVE OF DRUG FOR THE TREATMENT OF MUSCULAR DYSTROPHIES NICOX S.A. (FR) 2007-08-09 WO 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 (9 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-20090076174-A1 CONTROL RELEASE OF BIOLOGICALLY ACTIVE COMPOUNDS FROM MULTI-ARMED OLIGOMERS MME, CTSA, ALG1 PTGS2 3821/4885CDC42 404/4885RAC1 1380/4885
US-20230293557-A1 COMPOSITIONS AND METHODS FOR TREATING OPHTHALMIC CONDITIONS PDE6C, PDE6H, PDE6D PTGS2 101/4885CDC42 1785/4885RAC1 922/4885
US-20200246330-A1 ANTI-INFLAMMATORY, ANTI-CANCER, AND ANTI-ANGIOGENIC COMPOUNDS, PHARMACEUTICAL COMPOSITIONS, AND METHODS OF MAKING AND USING THEREOF VEGFA, HPGDS, ALOX5 PTGS2 18/4885CDC42 1826/4885RAC1 2830/4885
US-11752146-B2 Anti-inflammatory, anti-cancer, and anti-angiogenic compounds, pharmaceutical compositions, and methods of making and using thereof VEGFA, HPGDS, ALOX5 PTGS2 18/4885CDC42 1826/4885RAC1 2830/4885
US-20240016799-A1 ANTI-INFLAMMATORY, ANTI-CANCER, AND ANTI-ANGIOGENIC COMPOUNDS, PHARMACEUTICAL COMPOSITIONS, AND METHODS OF MAKING AND USING THEREOF VEGFA, HPGDS, ALOX5 PTGS2 18/4885CDC42 1826/4885RAC1 2830/4885
US-20230157952-A1 METHOD FOR IMPROVING THE STABILITY OF A PHARMACEUTICAL COMPOSITION COMPRISING A HIGH PENETRATION DRUG, AND THE PHARMACEUTICAL COMPOSITION OBTAINED THEREFROM SLC7A1, ABCG2, SLCO4C1 PTGS2 619/4885CDC42 4482/4885RAC1 4845/4885
US-20110118303-A1 NOVEL COMPOUNDS DERIVED FROM TAURINE, PROCESS OF THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THESE TPMT, UTS2R, NSUN3 PTGS2 217/4885CDC42 4577/4885RAC1 3486/4885
US-20090093510-A1 Use of Nitrooxyderivatives of Drug for the Treatment of Muscular Dystrophies TNNC1, CPT1B, SMN1; SMN2 PTGS2 440/4885CDC42 2216/4885RAC1 898/4885
US-20130137765-A1 USE OF NITROOXYDERIVATIVE OF DRUG FOR THE TREATMENT OF MUSCULAR DYSTROPHIES TNNC1, CPT1B, SMN1; SMN2 PTGS2 489/4885CDC42 1879/4885RAC1 911/4885

“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.