SCHEMBL6830447

SCHEMBL6830447

N[C@@H](CC(=O)N[C@@H](Cc1ccccc1)C(=O)O)C(=O)O

nearest known ligand 0.71

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ ACE P12821 5/20 0.62
▸ ECE1 P42892 1/20 0.59
▸ ALPI P09923 1/20 0.59
▸ PKM P14618 1/20 0.59
▸ PTGS1 P23219 1/20 0.59
▸ XIAP P98170 1/20 0.59
▸ SLC7A5 Q01650 1/20 0.59
▸ SLC1A3 P43003 3/20 0.55
▸ SLC1A2 P43004 3/20 0.55
▸ SLC1A1 P43005 3/20 0.55
▸ MME P08473 1/20 0.55
▸ NPSR1 Q6W5P4 1/20 0.54
▸ NAALAD2 Q9Y3Q0 1/20 0.52
▸ LMNA P02545 1/20 0.52

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
SCHEMBL18222570 1.00 ACE (0.62) ACEECE1ALPIPKMPTGS1
SCHEMBL9300989 1.00 ACE (0.62) ACEECE1ALPIPKMPTGS1
SCHEMBL8605262 1.00 ACE (0.62) ACEECE1ALPIPKMPTGS1
SCHEMBL10694682 1.00 ACE (0.62) ACEECE1ALPIPKMPTGS1
SCHEMBL8213279 0.98 ACE (0.60) ACEECE1ALPIPKMPTGS1
SCHEMBL7999080 0.91 MME (0.54) ACEECE1ALPIPKMPTGS1
SCHEMBL27516456 0.91 MME (0.54) ACEECE1ALPIPKMPTGS1
Potassium Ion SCHEMBL8213281 0.88 ALPI (0.53) ACEECE1ALPIPKMPTGS1
SCHEMBL18222587 0.88 ACE (0.64) ACESLC7A5MMENAALAD2
SCHEMBL9301967 0.87 ATM (0.58) LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114983953-A Ibuprofen tablet 哈尔滨凯程制药有限公司 2022-09-02 — — CN claimed
EP-0510552-B2 Preparation process of alpha-aspartyl-L-phenylalanine methyl ester MITSUI TOATSU CHEMICALS (JP) 2000-11-15 — — EP claimed
US-6015792-A Specific eatable taste modifiers BIORESEARCH, INC. (US) 2000-01-18 — — US claimed
US-5631038-A COMPOUNDS (TASTANDS) TO REDUCE OR ELIMINATE A BITTER OR METALLIC TASTE ARE ADDED TO FOODS CONTAINING SODIUM CHLORIDE BIORESEARCH, INC. (US) 1997-05-20 — — US 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-0600521-B1 Method for preparing alpha-L-aspartyl-L-phenylalanine AJINOMOTO KK (JP) 1997-02-19 — — EP claimed
EP-0556485-B1 Method for purifying alpha-L-aspartyl-L-phenylalanine methyl ester AJINOMOTO KK (JP) 1995-11-15 — — EP 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
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
JP-63270652-A — — None — — JP disclosed
WO-2025044828-A9 USE AND COMPOSITION OF POSTBIOTIC OF LACTOBACILLUS PARACASEI ET-22 内蒙古伊利实业集团股份有限公司 2025-04-03 — — WO disclosed
WO-2025044828-A1 USE AND COMPOSITION OF POSTBIOTIC OF LACTOBACILLUS PARACASEI ET-22 内蒙古伊利实业集团股份有限公司 2025-03-06 — — WO disclosed
CN-114983953-A Ibuprofen tablet 哈尔滨凯程制药有限公司 2022-09-02 — — CN disclosed
EP-3087094-B1 BETA-HAIRPIN PEPTIDOMIMETICS AS SELECTIVE ELASTASE INHIBITORS POLYPHOR AG (CH) 2022-06-01 — — EP disclosed
EP-0027319-B1 METHOD FOR REDUCTIVE ELIMINATION OF PROTECTING GROUPS AND PREPARATIVE PROCESS USING SUCH METHOD AJINOMOTO CO., INC. (JP) 1982-08-11 — — EP disclosed
US-4332718-A ANHYDRIDING, ACYLATION AJINOMOTO COMPANY, INC. (JP) 1982-06-01 — — US disclosed
EP-0035047-A1 Process for the production of an alpha-L-aspartyl-L-phenylalanine lower alkyl ester and an intermediate therefor AJINOMOTO CO., INC. (JP) 1981-09-09 — — EP disclosed
EP-0027319-A2 Method for reductive elimination of protecting groups and preparative process using such method AJINOMOTO CO., INC. (JP) 1981-04-22 — — EP disclosed
US-3933781-A Process for the preparation of α-L-aspartyl-L-phenylalanine alkyl esters MONSANTO COMPANY (US) 1976-01-20 — — US disclosed
Send feedback