SCHEMBL29640269

SCHEMBL29640269

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

nearest known ligand 0.56

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ECE1 P42892 2/20 0.56
SLC7A5 Q01650 1/20 0.50
MME P08473 3/20 0.46
ALDH1A1 P00352 2/20 0.44
BACE1 P56817 3/20 0.44
CTSD P07339 1/20 0.44
MAPT P10636 1/20 0.44
LAP3 P28838 3/20 0.43
PDCD1LG2 Q9BQ51 1/20 0.43
CD274 Q9NZQ7 1/20 0.43
MMP8 P22894 1/20 0.42
MEN1 O00255 1/20 0.42
LMNA P02545 1/20 0.42
KMT2A Q03164 1/20 0.42

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
SCHEMBL29447329 0.97 ECE1 (0.54) ECE1SLC7A5MMEALDH1A1BACE1
SCHEMBL29538126 0.95 ECE1 (0.52) ECE1SLC7A5MMEALDH1A1BACE1
SCHEMBL30507894 0.94 ECE1 (0.51) ECE1SLC7A5MMEBACE1CTSD
SCHEMBL29883560 0.93 ECE1 (0.50) ECE1SLC7A5MMEBACE1CTSD
SCHEMBL9657142 0.90 ALDH1A1 (0.53) ECE1SLC7A5MMEALDH1A1MAPT
SCHEMBL31073604 0.90 MME (0.55) ECE1SLC7A5MMEBACE1CTSD
Hydrochloric Acid SCHEMBL23404094 0.89 ALDH1A1 (0.51) ECE1SLC7A5MMEALDH1A1MAPT
SCHEMBL30956311 0.88 BACE1 (0.48) ECE1MMEALDH1A1BACE1CTSD
SCHEMBL31752207 0.88 MME (0.55) SLC7A5MMEALDH1A1MAPTLAP3
SCHEMBL7822916 0.88 MME (0.55) SLC7A5MMEALDH1A1MAPTLAP3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4329827-A1 TARGETING SYSTEM FOR CANCER COMPRISING A RADIOISOTOPE Alphathera AG (CH) 2024-03-06 EP claimed
CN-116660543-A Diagnostic and prognostic markers for nonalcoholic fatty liver disease and uses thereof 中国人民解放军陆军军医大学第一附属医院 2023-08-29 CN claimed
WO-2022240959-A2 COMPOSITIONS AND METHODS FOR TREATING AND/OR IDENTIFYING AN AGENT FOR TREATING HIV-1 INFECTIONS ALBERT EINSTEIN COLLEGE OF MEDICINE (US) 2022-11-17 WO claimed
WO-2022231424-A1 TARGETING SYSTEM FOR CANCER COMPRISING A RADIOISOTOPE ALPHATHERA AG (CH) 2022-11-03 WO claimed
WO-2022148418-A1 PHARMACEUTICAL COMPOSITION CAPABLE OF BEING DELIVERED BY METERED DOSE INHALER 江苏恒瑞医药股份有限公司 2022-07-14 WO claimed
US-20250295713-A1 COMPOSITIONS AND METHODS FOR IMPROVING SKIN HEALTH AND FOR THE TREATMENT AND PREVENTION OF DISEASES, DISORDERS AND CONDITIONS ASSOCIATED WITH PATHOGENIC MICROBES DERMBIONT, INC. 2025-09-25 US disclosed
WO-2025109003-A1 P-CADHERIN LIGANDS 3B PHARMACEUTICALS GMBH (DE) 2025-05-30 WO disclosed
CN-120005928-A Dynamic regulation and control system, strain, construction method of strain and application of strain in microbial fuel cell 天津科技大学 2025-05-16 CN disclosed
CN-119776332-A Enzymatic preparation process of histamine dihydrochloride 上海瀚鸿科技股份有限公司 2025-04-08 CN disclosed
CN-118308367-B Mulberry MaWRKY gene and application thereof 成都师范学院 2024-11-29 CN disclosed
CN-118909996-A Galactosyltransferase mutant and application thereof in preparation of flavonoid compounds 浙江大学 2024-11-08 CN disclosed
CN-118853640-A Carbapenem drug-resistant gene and application thereof 郑州大学 2024-10-29 CN disclosed
CN-113292508-B Synthetic method of cyclic dipeptide containing asparagine or glutamine 陕西慧康生物科技有限责任公司 2022-09-27 CN disclosed
WO-2022136555-A9 IMPROVED CD30 TARGETING ANTIBODY DRUG CONJUGATES AND USES THEREOF LUDWIG-MAXIMILIANS-UNIVERSITAET MUENCHEN (DE) 2022-09-22 WO disclosed
CN-113388620-B FcCGA 1 gene related to citrus disease resistance, primer pair, silencing vector and application 赣南师范大学 2022-08-26 CN disclosed
US-20220259265-A1 Inhibitors and Use Thereof in Cancer Treatment THE UNIVERSITY OF SYDNEY (AU) 2022-08-18 US disclosed
WO-2022148418-A1 PHARMACEUTICAL COMPOSITION CAPABLE OF BEING DELIVERED BY METERED DOSE INHALER 江苏恒瑞医药股份有限公司 2022-07-14 WO disclosed
WO-2022138957-A1 METHOD FOR PRODUCING LIPIDIC PEPTIDE 日産化学株式会社 2022-06-30 WO disclosed
WO-2022138953-A1 METHOD FOR PRODUCING LIPID PEPTIDE 日産化学株式会社 2022-06-30 WO disclosed
US-20220160617-A1 COMPOSITIONS AND METHODS FOR IMPROVING SKIN HEALTH AND FOR THE TREATMENT AND PREVENTION OF DISEASES, DISORDERS AND CONDITIONS ASSOCIATED WITH PATHOGENIC MICROBES DERMBIONT, INC. 2022-05-26 US disclosed