SCHEMBL4815779

SCHEMBL4815779

CC(C)(C)OC(=O)N[C@@H](C(=O)O)c1ccc(F)cc1

nearest known ligand 0.51

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CTSS P25774 4/20 0.51
CTSK P43235 4/20 0.51
S1PR3 Q99500 1/20 0.45
CYP3A4 P08684 1/20 0.42
CYP2D6 P10635 1/20 0.42
MAPT P10636 1/20 0.42
CYP2C9 P11712 1/20 0.42
TSHR P16473 1/20 0.42
CYP2C19 P33261 1/20 0.42
ATM Q13315 3/20 0.41
GABRB1 P18505 1/20 0.40
GABRB2 P47870 1/20 0.40
PPARA Q07869 2/20 0.40
PPARG P37231 1/20 0.40
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
ACE P12821 1/20 0.39

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
SCHEMBL266706 1.00 CTSS (0.51) CTSSCTSKS1PR3CYP3A4CYP2D6
SCHEMBL1162807 1.00 CTSS (0.51) CTSSCTSKS1PR3CYP3A4CYP2D6
SCHEMBL16174131 0.89 CTSS (0.49) CTSSCTSKS1PR3CYP3A4CYP2D6
SCHEMBL16171661 0.89 CTSS (0.49) CTSSCTSKS1PR3CYP3A4CYP2D6
SCHEMBL4076640 0.88 CTSS (0.45) CTSSCTSKS1PR3CYP3A4CYP2D6
SCHEMBL27813793 0.87 CTSS (0.47) CTSSCTSKS1PR3CYP3A4CYP2D6
SCHEMBL17723343 0.87 CTSS (0.47) CTSSCTSKS1PR3CYP3A4CYP2D6
SCHEMBL8513252 0.86 CTSS (0.52) CTSSCTSKS1PR3TSHRATM
SCHEMBL843924 0.86 CTSS (0.52) CTSSCTSKS1PR3ATMPPARA
SCHEMBL191986 0.86 CTSS (0.52) CTSSCTSKS1PR3ATMPPARA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118338897-A Compositions and methods for providing health benefits in animals using amino acid blends 雀巢产品有限公司 2024-07-12 CN claimed
EP-4262776-A1 COMPOSITIONS AND METHODS USING AT LEAST ONE GLYCINE OR DERIVATIVE THEREOF AND/OR AT LEAST ONE N-ACETYLCYSTEINE OR DERIVATIVE THEREOF, AND AT LEAST ONE THYMOL AND/OR CARVACROL Société des Produits Nestlé S.A. (CH) 2023-10-25 EP claimed
CN-116546981-A Compositions and methods using at least one glycine or derivative thereof and/or at least one N-acetylcysteine or derivative thereof and at least one thymol and/or carvacrol 雀巢产品有限公司 2023-08-04 CN claimed
CN-116456965-A Compositions and methods using at least one glycine or derivative thereof and at least one large neutral amino acid and/or cationic amino acid or precursor thereof 雀巢产品有限公司 2023-07-18 CN claimed
CN-115957294-A Beneficial effects of supplementation with N-acetylcysteine and glycine to improve glutathione levels 贝勒医学院 2023-04-14 CN claimed
WO-2022128870-A1 COMPOSITIONS AND METHODS USING AT LEAST ONE GLYCINE OR DERIVATIVE THEREOF AND/OR AT LEAST ONE N-ACETYLCYSTEINE OR DERIVATIVE THEREOF, AND AT LEAST ONE THYMOL AND/OR CARVACROL Société des Produits Nestlé S.A. (CH) 2022-06-23 WO claimed
CN-114163437-B Substituted pyrazolo [1,5-a ] pyridine compounds as RET kinase inhibitors 阿雷生物药品公司 2025-03-04 CN disclosed
EP-4405686-A1 METHOD FOR DETECTING AND/OR QUANTIFYING MOOD DISORDER AND/OR IMPROVEMENTS OF THE MOOD DISORDER STATUS USING CONJUGATED BILE ACIDS AS BIOMARKER AND IMPROVED METHODS AND COMPOSITIONS THEREOF Société des Produits Nestlé S.A. (CH) 2024-07-31 EP disclosed
CN-118338897-A Compositions and methods for providing health benefits in animals using amino acid blends 雀巢产品有限公司 2024-07-12 CN disclosed
CN-117940774-A Methods of using conjugated bile acids as biomarkers for detecting and/or quantifying mood disorders and/or mood disorder status improvement and improved methods and compositions thereof 雀巢产品有限公司 2024-04-26 CN disclosed
EP-4262776-A1 COMPOSITIONS AND METHODS USING AT LEAST ONE GLYCINE OR DERIVATIVE THEREOF AND/OR AT LEAST ONE N-ACETYLCYSTEINE OR DERIVATIVE THEREOF, AND AT LEAST ONE THYMOL AND/OR CARVACROL Société des Produits Nestlé S.A. (CH) 2023-10-25 EP disclosed
CN-116546981-A Compositions and methods using at least one glycine or derivative thereof and/or at least one N-acetylcysteine or derivative thereof and at least one thymol and/or carvacrol 雀巢产品有限公司 2023-08-04 CN disclosed
CN-116456965-A Compositions and methods using at least one glycine or derivative thereof and at least one large neutral amino acid and/or cationic amino acid or precursor thereof 雀巢产品有限公司 2023-07-18 CN disclosed
US-7462713-B2 Tricyclic compounds protein kinase inhibitors for enhancing the efficacy of anti-neoplastic agents and radiation therapy AGOURON PHARMACEUTICALS, INC. (US) 2008-12-09 US disclosed
US-20070265289-A1 2-Aminopyrimidine Derivative ASTELLAS PHARMA INC. (JP) 2007-11-15 US disclosed
US-20070135415-A1 TRICYCLIC COMPOUNDS PROTEIN KINASE INHIBITORS FOR ENHANCING THE EFFICACY OF ANTI-NEOPLASTIC AGENTS AND RADIATION THERAPY AGOURON PHARMACEUTICALS, INC. 2007-06-14 US disclosed
EP-1736472-A1 2-AMINOPYRIDINE DERIVATIVE Astellas Pharma Inc. (JP) 2006-12-27 EP disclosed
US-7132533-B2 Tricyclic compounds protein kinase inhibitors for enhancing the efficacy of anti-neoplastic agents and radiation therapy AGOURON PHARMACEUTICALS, INC. (US) 2006-11-07 US disclosed
US-20060004052-A1 Tricyclic compounds protein kinase inhibitors for enhancing the efficacy of anti-neoplastic agents and radiation therapy AGOURON PHARMACEUTICALS, INC. 2006-01-05 US disclosed
US-20050075499-A1 Tricyclic compounds protein kinase inhibitors for enhancing the efficacy of anti-neoplastic agents and radiation therapy AGOURON PHARMACEUTICALS, INC. 2005-04-07 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 (4 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-20060004052-A1 Tricyclic compounds protein kinase inhibitors for enhancing the efficacy of anti-neoplastic agents and radiation therapy CHEK1, CHEK2, CHKA CTSS 1118/4885CTSK 390/4885S1PR3 1604/4885
US-20050075499-A1 Tricyclic compounds protein kinase inhibitors for enhancing the efficacy of anti-neoplastic agents and radiation therapy CHEK2, CHEK1, CHKA CTSS 1108/4885CTSK 375/4885S1PR3 1743/4885
US-20070135415-A1 TRICYCLIC COMPOUNDS PROTEIN KINASE INHIBITORS FOR ENHANCING THE EFFICACY OF ANTI-NEOPLASTIC AGENTS AND RADIATION THERAPY CHEK1, CHEK2, CHKA CTSS 1040/4885CTSK 365/4885S1PR3 1315/4885
US-20070265289-A1 2-Aminopyrimidine Derivative NFKBIA, IKBKG, NFKB2 CTSS 4722/4885CTSK 4207/4885S1PR3 2460/4885

“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.