SCHEMBL309644

SCHEMBL309644

CC(C)(C)OC(=O)NC(Cc1ccc(O)cc1)C(=O)OC(C)(C)C

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CTSS P25774 6/20 0.67
CTSK P43235 5/20 0.67
LY96 Q9Y6Y9 1/20 0.56
CTSL P07711 1/20 0.53
CTSB P07858 1/20 0.53
ACE P12821 1/20 0.51
ITGB3 P05106 1/20 0.51
ITGA2B P08514 1/20 0.51
KLK5 Q9Y337 1/20 0.50
PPARA Q07869 2/20 0.49
MDM4 O15151 1/20 0.49
MDM2 Q00987 1/20 0.49
ITGA4 P13612 1/20 0.48
ITGB7 P26010 1/20 0.48
POLB P06746 1/20 0.47
MAPT P10636 1/20 0.47
TDP1 Q9NUW8 1/20 0.47
PPARG P37231 1/20 0.47
KMT2A Q03164 1/20 0.47
NPSR1 Q6W5P4 1/20 0.47

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
SCHEMBL2076110 1.00 CTSS (0.67) CTSSCTSKLY96CTSLCTSB
SCHEMBL14405376 1.00 CTSS (0.67) CTSSCTSKLY96CTSLCTSB
SCHEMBL539575 0.93 CTSS (0.66) CTSSCTSKLY96CTSLCTSB
SCHEMBL2574440 0.93 CTSS (0.66) CTSSCTSKLY96CTSLCTSB
SCHEMBL30374091 0.93 CTSS (0.66) CTSSCTSKLY96CTSLCTSB
SCHEMBL539574 0.93 CTSS (0.66) CTSSCTSKLY96CTSLCTSB
SCHEMBL7260689 0.91 CTSS (0.63) CTSSCTSKLY96CTSLCTSB
SCHEMBL920111 0.91 CTSS (0.63) CTSSCTSKLY96CTSLCTSB
SCHEMBL16470394 0.89 CTSS (0.62) CTSSCTSKLY96CTSLCTSB
SCHEMBL14884529 0.89 CTSS (0.62) CTSSCTSKLY96CTSLCTSB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250152590-A1 NURR1:RXR ACTIVATING COMPOUNDS FOR SIMULTANEOUS TREATMENT OF SYMPTOMS AND PATHOLOGY OF PARKINSON'S DISEASE VASSILATIS DEMETRIOS K (GR) 2025-05-15 US disclosed
CN-110475785-B Peptide compound, method for producing same, composition for screening, and method for selecting peptide compound 富士胶片株式会社 2023-06-13 CN disclosed
EP-4029857-A1 NURR1:RXR ACTIVATING COMPOUNDS FOR SIMULTANEOUS TREATMENT OF SYMPTOMS AND PATHOLOGY OF PARKINSON'S DISEASE Vassilatis, Demetrios K. (GR) 2022-07-20 EP disclosed
EP-3365329-B1 NURR1:RXR ACTIVATING COMPOUNDS FOR SIMULTANEOUS TREATMENT OF SYMPTOMS AND PATHOLOGY OF PARKINSON'S DISEASE VASSILATIS DEMETRIOS K (GR) 2022-03-30 EP disclosed
CN-108883099-B Thiazolidinone compounds and use thereof 石全 2021-09-28 CN disclosed
EP-3519407-B1 DIMETHYLAMINOETHANOL SALT OF A GLP-1 RECEPTOR MODULATOR RECEPTOS LLC (US) 2021-09-22 EP disclosed
US-20210186975-A1 NURR1:RXR ACTIVATING COMPOUNDS FOR SIMULTANEOUS TREATMENT OF SYMPTOMS AND PATHOLOGY OF PARKINSON'S DISEASE VASSILATIS DEMETRIOS K (GR) 2021-06-24 US disclosed
CN-107074820-B GLP-1 receptor modulators 赛尔基因第二国际有限公司 2021-05-18 CN disclosed
US-10946019-B2 Nurr1:RXR activating compounds for simultaneous treatment of symptoms and pathology of Parkinson's disease VASSILATIS DEMETRIOS K (GR) 2021-03-16 US disclosed
CN-112457301-A Novel GLP-1 receptor modulators 赛尔基因第二国际有限公司 2021-03-09 CN disclosed
US-20090029993-A1 METHODS OF AFFECTING GASTROINTESTINAL TRANSIT AND GASTRIC EMPTYING, AND COMPOUNDS USEFUL THEREIN LEXICON PHARMACEUTICALS, INC. 2009-01-29 US disclosed
WO-2009014972-A1 METHODS OF AFFECTING GASTROINTESTINAL TRANSIT AND GASTRIC EMPTYING, AND COMPOUNDS USEFUL THEREIN LEXICON PHARMACEUTICALS, INC. (US) 2009-01-29 WO disclosed
WO-2009009561-A1 METHODS AND COMPOSITIONS FOR TREATING PULMONARY HYPERTENSION AND RELATED DISEASES AND DISORDERS LEXICON PHARMACEUTICALS, INC. (US) 2009-01-15 WO disclosed
US-20090005381-A1 METHODS OF TREATING SEROTONIN-MEDIATED DISEASES AND DISORDERS LEXICON PHARMACEUTICALS, INC. 2009-01-01 US disclosed
US-20090005382-A1 METHODS OF USING AND COMPOSITIONS COMPRISING TRYPTOPHAN HYDROXYLASE INHIBITORS TERSERA THERAPEUTICS LLC 2009-01-01 US disclosed
WO-2009002964-A1 METHODS OF TREATING SEROTONIN-MEDIATED DISEASES AND DISORDERS LEXICON PHARMACEUTICALS, INC. (US) 2008-12-31 WO disclosed
WO-2009002970-A1 COMPOSITIONS COMPRISING TRYPTOPHAN HYDROXYLASE INHIBITORS LEXICON PHARMACEUTICALS, INC. (US) 2008-12-31 WO disclosed
EP-1984344-A2 MULTICYCLIC AMINO ACID DERIVATIVES AND METHODS OF THEIR USE Lexicon Pharmaceuticals, Inc. (US) 2008-10-29 EP disclosed
US-20070191370-A1 Multicyclic amino acid derivatives and methods of their use TERSERA THERAPEUTICS LLC 2007-08-16 US disclosed
WO-2007089335-A2 MULTICYCLIC AMINO ACID DERIVATIVES AND METHODS OF THEIR USE LEXICON PHARMACEUTICAL INC. (US) 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 (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-20250152590-A1 NURR1:RXR ACTIVATING COMPOUNDS FOR SIMULTANEOUS TREATMENT OF SYMPTOMS AND PATHOLOGY OF PARKINSON'S DISEASE NR4A2, NR0B1, NCOR1 CTSS 3686/4885CTSK 4045/4885LY96 1829/4885
US-20070191370-A1 Multicyclic amino acid derivatives and methods of their use AADAT, HNMT, TPH1 CTSS 1308/4885CTSK 1644/4885LY96 2589/4885
US-20090005381-A1 METHODS OF TREATING SEROTONIN-MEDIATED DISEASES AND DISORDERS TPH1, TPH2, HNMT CTSS 941/4885CTSK 1278/4885LY96 1285/4885
US-20210186975-A1 NURR1:RXR ACTIVATING COMPOUNDS FOR SIMULTANEOUS TREATMENT OF SYMPTOMS AND PATHOLOGY OF PARKINSON'S DISEASE NR4A2, NR0B1, NR4A3 CTSS 3577/4885CTSK 3923/4885LY96 1965/4885
US-20090029993-A1 METHODS OF AFFECTING GASTROINTESTINAL TRANSIT AND GASTRIC EMPTYING, AND COMPOUNDS USEFUL THEREIN TPH1, TPH2, HNMT CTSS 932/4885CTSK 1016/4885LY96 2625/4885
US-10946019-B2 Nurr1:RXR activating compounds for simultaneous treatment of symptoms and pathology of Parkinson's disease NR4A2, NR0B1, NR4A3 CTSS 3577/4885CTSK 3923/4885LY96 1965/4885
US-20090005382-A1 METHODS OF USING AND COMPOSITIONS COMPRISING TRYPTOPHAN HYDROXYLASE INHIBITORS TPH1, TPH2, MAOB CTSS 830/4885CTSK 1104/4885LY96 2964/4885

“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.