SCHEMBL584507

SCHEMBL584507

CCC(C)C(NO)C(=O)O

nearest known ligand 0.59

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.59
L3MBTL1 Q9Y468 1/20 0.50
FPR2 P25090 2/20 0.44
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
ATM Q13315 1/20 0.44
MME P08473 1/20 0.42
ACE P12821 1/20 0.42
CPA1 P15085 1/20 0.42
ACE2 Q9BYF1 1/20 0.42
CA2 P00918 2/20 0.41
CA1 P00915 1/20 0.41
ENPEP Q07075 2/20 0.40
MAPK1 P28482 1/20 0.40
CYP2C9 P11712 1/20 0.40
CYP2C19 P33261 1/20 0.40
TYR P14679 1/20 0.38

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
SCHEMBL4753641 1.00 ALDH1A1 (0.59) ALDH1A1L3MBTL1FPR2MEN1KMT2A
SCHEMBL23260544 1.00 ALDH1A1 (0.59) ALDH1A1L3MBTL1FPR2MEN1KMT2A
SCHEMBL584508 1.00 ALDH1A1 (0.59) ALDH1A1L3MBTL1FPR2MEN1KMT2A
SCHEMBL4753811 1.00 ALDH1A1 (0.59) ALDH1A1L3MBTL1FPR2MEN1KMT2A
SCHEMBL250457 0.81 ALDH1A1 (0.59) ALDH1A1L3MBTL1FPR2MEN1KMT2A
SCHEMBL288609 0.81 ALDH1A1 (0.59) ALDH1A1L3MBTL1FPR2MEN1KMT2A
SCHEMBL43380 0.81 ALDH1A1 (0.59) ALDH1A1L3MBTL1FPR2MEN1KMT2A
SCHEMBL18560091 0.81 ALDH1A1 (0.59) ALDH1A1L3MBTL1FPR2MEN1KMT2A
SCHEMBL2034664 0.81 ALDH1A1 (0.59) ALDH1A1L3MBTL1FPR2MEN1KMT2A
SCHEMBL43381 0.81 ALDH1A1 (0.59) ALDH1A1L3MBTL1FPR2MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3661938-B1 NOVEL METHOD FOR SYNTHESIZING AMANITINS HEIDELBERG PHARMA RES GMBH (DE) 2025-01-15 EP claimed
CN-118360279-A Polynucleotide having lysE gene promoter activity and application thereof 中国科学院天津工业生物技术研究所 2024-07-19 CN claimed
US-20230332116-A1 POLYPEPTIDE WITH ASPARTATE KINASE ACTIVITY AND USE THEREOF IN PRODUCTION OF AMINO ACID TIANJIN INSTITUTE OF INDUSTRIAL BIOTECHNOLOGY, CHINESE ACADEMY OF SCIENCES (CN) 2023-10-19 US claimed
EP-4230723-A1 POLYPEPTIDE WITH ASPARTATE KINASE ACTIVITY AND USE THEREOF IN PRODUCTION OF AMINO ACID Tianjin Institute of Industrial Biotechnology, Chinese Academy of Sciences (CN) 2023-08-23 EP claimed
CN-109988312-B Polyamide acid ester, preparation method, negative polyimide composition and application 深圳先进技术研究院 2023-04-11 CN claimed
CN-115715294-A Method for synthesizing thioether-containing peptides 海德堡医药研究有限责任公司 2023-02-24 CN claimed
CN-112481186-B Genetic engineering bacterium for producing 4-hydroxyisoleucine and application thereof 天津科技大学 2023-02-03 CN claimed
CN-113201514-B Polypeptides having aspartokinase activity and their use for producing amino acids 中国科学院天津工业生物技术研究所 2022-09-06 CN claimed
CN-113201514-A Polypeptides having aspartokinase activity and their use for producing amino acids 中国科学院天津工业生物技术研究所 2021-08-03 CN claimed
CN-107149567-B Plant mosquito-repellent spray for infants and preparation process thereof 虞琼斐 2021-01-12 CN claimed
US-20060014159-A1 Methods of determining precise HERG interactions and designing compounds based on said interactions NEURION PHARMACEUTICALS, INC. (US) 2006-01-19 US claimed
US-20050202103-A1 Pregnane Glycoside compositions and caralluma extract products and uses thereof RAJENDRAN RAMASWAMY (IN) 2005-09-15 US claimed
WO-2004100968-A2 A SYNERGISTIC COMPOSITION FOR THE TREATMENT OF DIABETES MELLITUS INDUS BIOTECH PVT. LTD. (IN) 2004-11-25 WO claimed
WO-2004034986-A2 AGGLOMERATED GRANULAR PROTEIN-RICH NUTRITIONAL SUPPLEMENT BASIC RESEARCH, L.L.C. (US) 2004-04-29 WO claimed
CN-1065538-C Antibiotic stalobacins SHIONOGI & CO (JP) 2001-05-09 CN claimed
US-6103231-A Antibiotic stalobacins SHIONOGI & CO., LTD. (JP) 2000-08-15 US claimed
CN-1142230-A Antibiotic stalobacins SHIONOGI & CO (JP) 1997-02-05 CN claimed
EP-0748335-A1 ANTIBIOTIC STALOBACINS SHIONOGI & CO., LTD. (JP) 1996-12-18 EP claimed
US-5456910-A Peptide antibiotics useful against grampositive bacteria SHIONOGI & CO., LTD. (JP) 1995-10-10 US claimed
WO-1995023812-A1 ANTIBIOTIC STALOBACINS SHIONOGI & CO., LTD. (JP) 1995-09-08 WO claimed

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-20060014159-A1 Methods of determining precise HERG interactions and designing compounds based on said interactions KCNN4, KCNC1, HCN4 ALDH1A1 3649/4885L3MBTL1 219/4885FPR2 4490/4885

“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.