SCHEMBL2742702

SCHEMBL2742702

CCN(CC)Cc1ccc(C(=O)N(CCc2ccccc2OC)[C@@H]2CCNC2)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
MBTPS1 Q14703 20/20 1.00
F10 P00742 1/20 1.00
PLAU P00749 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
SCHEMBL29363326 1.00 MBTPS1 (1.00) MBTPS1F10PLAU
SCHEMBL21853304 1.00 MBTPS1 (1.00) MBTPS1F10PLAU
Hydrochloric Acid SCHEMBL20541310 0.99 MBTPS1 (0.98) MBTPS1F10PLAU
Hydrochloric Acid SCHEMBL20541308 0.99 MBTPS1 (0.98) MBTPS1F10PLAU
SCHEMBL21853303 0.83 MBTPS1 (0.71) MBTPS1F10PLAU
SCHEMBL4210498 0.73 MBTPS1 (0.59) MBTPS1F10PLAU
SCHEMBL4919198 0.67 TACR1 (0.52) MBTPS1F10PLAU
SCHEMBL340465 0.67 SLC6A2 (0.51) MBTPS1F10PLAU
SCHEMBL7262616 0.66 MBTPS1 (0.52) MBTPS1F10PLAU
SCHEMBL476886 0.65 SLC6A2 (0.60)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112773791-B Application of S1P inhibitor in preparation of medicines for treating neurodegenerative diseases 徐州医科大学 2022-09-23 CN claimed
CN-112773791-A Application of S1P inhibitor in preparation of medicines for treating neurodegenerative diseases 徐州医科大学 2021-05-11 CN claimed
EP-3612174-B1 METHODS AND PHARMACEUTICAL COMPOSITIONS FOR THE TREATMENT OF DISEASES ASSOCIATED WITH REDUCED CFTR FUNCTION INST NAT SANTE RECH MED (FR) 2023-02-22 EP disclosed
US-11534423-B2 Methods and compositions for improving exercise endurance, performance, or tolerance WASHINGTON UNIVERSITY (US) 2022-12-27 US disclosed
US-11458118-B2 Methods and pharmaceutical compositions for the treatment of diseases associated with reduced CFTR function INSERM (Institut National de la Santé et de la Recherche Médicale) (FR) 2022-10-04 US disclosed
CN-112773791-B Application of S1P inhibitor in preparation of medicines for treating neurodegenerative diseases 徐州医科大学 2022-09-23 CN disclosed
US-11202795-B2 Means and methods for treatment of early-onset Parkinson's disease VIB VZW (BE) 2021-12-21 US disclosed
CN-112773791-A Application of S1P inhibitor in preparation of medicines for treating neurodegenerative diseases 徐州医科大学 2021-05-11 CN disclosed
US-20200215032-A1 METHODS AND COMPOSITIONS FOR IMPROVING EXERCISE ENDURANCE, PERFORMANCE, OR TOLERANCE WASHINGTON UNIVERSITY (US) 2020-07-09 US disclosed
US-20200121642-A1 METHODS AND PHARMACEUTICAL COMPOSITIONS FOR THE TREATMENT OF DISEASES ASSOCIATED WITH REDUCED CFTR FUNCTION UNIVERSITÉ DE BRETAGNE OCCIDENTALE (FR) 2020-04-23 US disclosed
EP-3612174-A1 METHODS AND PHARMACEUTICAL COMPOSITIONS FOR THE TREATMENT OF DISEASES ASSOCIATED WITH REDUCED CFTR FUNCTION Institut National de la Sante et de la Recherche Medicale (INSERM) (FR) 2020-02-26 EP disclosed
US-20110053947-A1 Arylchalcogenoarylalkyl-substituted imidazolidine-2,4-diones, process for preparation thereof, medicaments comprising these compounds and use thereof SANOFI-AVENTIS (FR) 2011-03-03 US disclosed
US-20110053947-A1 Arylchalcogenoarylalkyl-substituted imidazolidine-2,4-diones, process for preparation thereof, medicaments comprising these compounds and use thereof SANOFI-AVENTIS (FR) 2011-03-03 US disclosed
US-20110046185-A1 Arylchalcogenoarylalkyl-substituted imidazolidine-2,4-diones, process for preparation thereof, medicaments comprising these compounds and use thereof SANOFI-AVENTIS (FR) 2011-02-24 US disclosed
US-20110046185-A1 Arylchalcogenoarylalkyl-substituted imidazolidine-2,4-diones, process for preparation thereof, medicaments comprising these compounds and use thereof SANOFI-AVENTIS (FR) 2011-02-24 US disclosed
US-20110046105-A1 Heterocycle-substituted imidazolidine-2,4-diones, process for preparation thereof, medicaments comprising them and use thereof SANOFI-AVENTIS (FR) 2011-02-24 US disclosed
US-20110046105-A1 Heterocycle-substituted imidazolidine-2,4-diones, process for preparation thereof, medicaments comprising them and use thereof SANOFI-AVENTIS (FR) 2011-02-24 US disclosed
US-20100249097-A1 NOVEL SUBSTITUTED TETRAHYDRONAPHTHALENES, PROCESS FOR THE PREPARATION THEREOF AND THE USE THEREOF AS MEDICAMENTS SANOFI-AVENTIS (FR) 2010-09-30 US disclosed
US-20100249097-A1 NOVEL SUBSTITUTED TETRAHYDRONAPHTHALENES, PROCESS FOR THE PREPARATION THEREOF AND THE USE THEREOF AS MEDICAMENTS SANOFI-AVENTIS (FR) 2010-09-30 US disclosed
WO-2010000401-A1 USE OF SUBSTITUTED PYRIDINONE CARBOXYLIC ACID DERIVATES FOR PRODUCING PHARMACEUTICALS FOR THE TREATMENT OF DYSLIPIDEMIA SANOFI-AVENTIS (FR) 2010-01-07 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 (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-11534423-B2 Methods and compositions for improving exercise endurance, performance, or tolerance S1PR1, S1PR2, S1PR3 MBTPS1 1890/4885F10 4612/4885PLAU 3383/4885
US-20110046185-A1 Arylchalcogenoarylalkyl-substituted imidazolidine-2,4-diones, process for preparation thereof, medicaments comprising these compounds and use thereof PGC, LIPC, CEL MBTPS1 4375/4885F10 879/4885PLAU 3340/4885
US-20110046105-A1 Heterocycle-substituted imidazolidine-2,4-diones, process for preparation thereof, medicaments comprising them and use thereof GIPR, DDC, PGC MBTPS1 4589/4885F10 560/4885PLAU 3477/4885
US-20100249097-A1 NOVEL SUBSTITUTED TETRAHYDRONAPHTHALENES, PROCESS FOR THE PREPARATION THEREOF AND THE USE THEREOF AS MEDICAMENTS DHPS, CYP11B2, CYP11B1 MBTPS1 2453/4885F10 2485/4885PLAU 2744/4885
US-20110053947-A1 Arylchalcogenoarylalkyl-substituted imidazolidine-2,4-diones, process for preparation thereof, medicaments comprising these compounds and use thereof PGC, LIPC, CEL MBTPS1 4395/4885F10 878/4885PLAU 3233/4885
US-11202795-B2 Means and methods for treatment of early-onset Parkinson's disease PINK1, PARK7, SNCA MBTPS1 1637/4885F10 4438/4885PLAU 2691/4885
US-20200215032-A1 METHODS AND COMPOSITIONS FOR IMPROVING EXERCISE ENDURANCE, PERFORMANCE, OR TOLERANCE S1PR1, S1PR2, S1PR3 MBTPS1 1890/4885F10 4612/4885PLAU 3383/4885

“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.