SCHEMBL6549557

SCHEMBL6549557

COC(=O)[C@H](Cc1ccccc1)NC(=O)C[C@H](N)C(=O)O

nearest known ligand 0.72

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.58
KLK5 Q9Y337 1/20 0.57
ALDH1A1 P00352 3/20 0.56
THRB P10828 1/20 0.56
CYP2C9 P11712 1/20 0.56
CYP2C19 P33261 1/20 0.56
HSD17B10 Q99714 1/20 0.56
POLB P06746 1/20 0.55
LMNA P02545 2/20 0.54
MEN1 O00255 1/20 0.54
KMT2A Q03164 1/20 0.54
GLA P06280 1/20 0.53
HDAC1 Q13547 3/20 0.53
HDAC6 Q9UBN7 3/20 0.53
MDM4 O15151 1/20 0.53
MDM2 Q00987 1/20 0.53

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
SCHEMBL8603038 1.00 ATM (0.58) ATMKLK5ALDH1A1THRBCYP2C9
SCHEMBL11406714 1.00 ATM (0.58) ATMKLK5ALDH1A1THRBCYP2C9
SCHEMBL9301967 1.00 ATM (0.58) ATMKLK5ALDH1A1THRBCYP2C9
Hydrochloric Acid SCHEMBL9492789 0.99 ATM (0.56) ATMKLK5ALDH1A1THRBCYP2C9
SCHEMBL8603938 0.93 ATM (0.59) ATMKLK5ALDH1A1THRBCYP2C9
SCHEMBL8603937 0.93 ATM (0.59) ATMKLK5ALDH1A1THRBCYP2C9
Hydrochloric Acid SCHEMBL10412319 0.92 ATM (0.58) ATMKLK5ALDH1A1THRBCYP2C9
SCHEMBL8086148 0.92 ALDH1A1 (0.55) ATMKLK5ALDH1A1THRBCYP2C9
SCHEMBL237136 0.89 ACE (0.57) ATMKLK5
SCHEMBL22013341 0.89 ATM (0.60) ATMKLK5ALDH1A1THRBCYP2C9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0510552-B2 Preparation process of alpha-aspartyl-L-phenylalanine methyl ester MITSUI TOATSU CHEMICALS (JP) 2000-11-15 EP claimed
EP-0526854-B1 Method for recovery of alpha-L-aspartyl-L-phenylalanine methyl ester, L-phenylalanine and l-aspartic acid AJINOMOTO KK (JP) 1997-05-02 EP claimed
EP-0556485-B1 Method for purifying alpha-L-aspartyl-L-phenylalanine methyl ester AJINOMOTO KK (JP) 1995-11-15 EP claimed
US-5424477-A Preparation process of α-aspartyl-L-phenylalanine methyl ester MITSUI TOATSU CHEMICALS INCORPORATED (JP) 1995-06-13 US claimed
US-5304671-A Solid-liquid separation of suspension; no desalting; precipitation of acid salt; neutralization; hydrolysis AJINOMOTO CO., INC. (JP) 1994-04-19 US claimed
EP-0556485-A1 Method for purifying alpha-L-aspartyl-L-phenylalanine methyl ester Ajinomoto Co., Inc. (JP) 1993-08-25 EP claimed
US-5225587-A Method of producing α-L-aspartyl-L-phenylalanine methyl ester hydrochloride AJINOMOTO CO., INC. (JP) 1993-07-06 US claimed
WO-1993010677-A1 SPECIFIC EATABLE TASTE MODIFIERS BIORESEARCH, INC. (US) 1993-06-10 WO claimed
EP-0510552-A1 Preparation process of alpha-aspartyl-L-phenylalanine methyl ester MITSUI TOATSU CHEMICALS, Inc. (JP) 1992-10-28 EP claimed
JP-63150295-A None JP disclosed
US-20250025438-A1 Derivative of aspartic acid and use thereof in treatment of metabolic diseases such as hepatic fibrosis and non-alcoholic hepatitis SHENZHEN JINGTAI TECHNOLOGY CO., LTD. (CN) 2025-01-23 US disclosed
CN-118234705-A Aspartic acid derivative and application thereof in treatment of liver fibrosis, nonalcoholic hepatitis and other metabolic diseases 深圳利沃生物医药科技有限公司 2024-06-21 CN disclosed
CN-109477116-B Rebaudioside analogues 百事可乐公司 2024-06-07 CN disclosed
WO-2023083291-A1 DERIVATIVE OF ASPARTIC ACID AND USE THEREOF IN TREATMENT OF METABOLIC DISEASES SUCH AS HEPATIC FIBROSIS AND NON-ALCOHOLIC HEPATITIS 深圳利沃生物医药科技有限公司 2023-05-19 WO disclosed
EP-0132856-A2 Process for preparing alpha-L-aspartyl-L-phenylalanine methyl ester DE-BI DERIVATI BIOLOGICI INTERNATIONAL S.p.A. (IT) 1985-02-13 EP disclosed
EP-0127411-A2 Method of preparing alpha-l-aspartyl-l-phenylalanine methyl ester and its hydrochloride AJINOMOTO CO., INC. (JP) 1984-12-05 EP disclosed
EP-0102529-A2 Process for preparation of aspartylphenylalanine alkyl esters Tosoh Corporation (JP) 1984-03-14 EP disclosed
EP-0092933-A1 Process for producing alpha-L-aspartyl-L-phenylalanine methyl ester or its hydrochloride AJINOMOTO CO., INC. (JP) 1983-11-02 EP disclosed
EP-0074095-A1 Process for preparation of aspartylphenylalanine alkyl esters TOYO SODA MANUFACTURING CO., LTD. (JP) 1983-03-16 EP disclosed
US-4017472-A Process for isolation of aspartyl dipeptide esters G. D. SEARLE & CO. (US) 1977-04-12 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 (1 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-20250025438-A1 Derivative of aspartic acid and use thereof in treatment of metabolic diseases such as hepatic fibrosis and non-alcoholic hepatitis GOT1, GOT2, GLS2 ATM 2208/4885KLK5 1770/4885ALDH1A1 38/4885

“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.