SCHEMBL6256947

SCHEMBL6256947

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

nearest known ligand 0.60

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.60
PLA2G2A P14555 2/20 0.57
PLA2G5 P39877 2/20 0.57
MEN1 O00255 1/20 0.56
LMNA P02545 1/20 0.56
KMT2A Q03164 1/20 0.56
FOLH1 Q04609 6/20 0.54
MAPT P10636 1/20 0.53
GRN P28799 1/20 0.49
SORT1 Q99523 1/20 0.49
MME P08473 1/20 0.49
LAP3 P28838 3/20 0.47
NOD1 Q9Y239 1/20 0.47
PSMB5 P28074 1/20 0.47

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
SCHEMBL6256944 1.00 ALDH1A1 (0.60) ALDH1A1PLA2G2APLA2G5MEN1LMNA
Benzene SCHEMBL27688929 0.96 ALDH1A1 (0.56) ALDH1A1PLA2G2APLA2G5MEN1LMNA
SCHEMBL15692314 0.93 ALDH1A1 (0.53) ALDH1A1PLA2G2APLA2G5MEN1LMNA
SCHEMBL15649008 0.93 ALDH1A1 (0.53) ALDH1A1PLA2G2APLA2G5MEN1LMNA
Leucine SCHEMBL15648550 0.90 SLC7A5 (0.56) ALDH1A1PLA2G2APLA2G5MEN1LMNA
SCHEMBL14637109 0.89 PLA2G2A (0.62) ALDH1A1PLA2G2APLA2G5MEN1LMNA
SCHEMBL9073825 0.88 ALDH1A1 (0.51) ALDH1A1PLA2G2APLA2G5MEN1LMNA
SCHEMBL12228501 0.87 ALDH1A1 (0.47) ALDH1A1PLA2G2APLA2G5MEN1LMNA
SCHEMBL7333737 0.87 PLA2G2A (0.69) ALDH1A1PLA2G2APLA2G5MEN1LMNA
SCHEMBL9664224 0.87 PLA2G2A (0.69) ALDH1A1PLA2G2APLA2G5MEN1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230368914-A1 SYSTEMS AND METHODS FOR COMPUTER-IMPLEMENTED METABOLITE ANALYSIS AND PREDICTION FOR ANIMAL SUBJECTS DSM IP ASSETS B.V. (NL) 2023-11-16 US claimed
US-20220221433-A1 MASS SPECTROMETRY ASSAY METHODS FOR DETECTION OF METABOLITES METABOLON, INC. 2022-07-14 US claimed
EP-3977112-A1 MASS SPECTROMETRY ASSAY METHODS FOR DETECTION OF METABOLITES Metabolon Inc. (US) 2022-04-06 EP claimed
CN-113892029-A Mass spectrometry method for detecting metabolites 梅塔博隆股份有限公司 2022-01-04 CN claimed
WO-2020242744-A1 MASS SPECTROMETRY ASSAY METHODS FOR DETECTION OF METABOLITES METABOLON, INC. (US) 2020-12-03 WO claimed
US-4859653-A Use of compositions of matter containing N-acylates of alpha aminoacids for the treatment of skin MORELLE JEAN V (FR) 1989-08-22 US claimed
US-20250000948-A1 SOLID COMPOSITIONS COMPRISING A PEPTIDE OR A PROTEIN AND AN ACYLATED AMINO ACID ADOCIA (FR) 2025-01-02 US disclosed
US-20240390433-A1 GENETICALLY MODIFIED BACILLUS SUBTILIS STRAIN AND USE AS A LIVE DELIVERY AND PRODUCTION SYSTEM BIOMEDIT, INC. 2024-11-28 US disclosed
EP-4433093-A1 SOLID COMPOSITIONS COMPRISING A PEPTIDE OR A PROTEIN AND AN ACYLATED AMINO ACID Adocia (FR) 2024-09-25 EP disclosed
CN-118488855-A Solid composition comprising peptide or protein and acylated amino acid 阿道恰公司 2024-08-13 CN disclosed
EP-4387638-A1 GENETICALLY MODIFIED BACILLUS SUBTILIS STRAIN AND USE AS A LIVE DELIVERY AND PRODUCTION SYSTEM BiomEdit, LLC (US) 2024-06-26 EP disclosed
EP-4386090-A1 METHOD FOR DETERMINING AND IMPROVING THE POTENTIAL EFFICACY OF ANTICANCER TREATMENT ASSISTANCE PUBLIQUE - HÔPITAUX DE PARIS (FR) 2024-06-19 EP disclosed
EP-4299057-A1 SOLID COMPOSITIONS COMPRISING A PEPTIDE OR A PROTEIN AND AN ACYLATED AMINO ACID Adocia (FR) 2024-01-03 EP disclosed
US-6149924-A FOR TOPICAL APPLICATION BIOMED RESEARCH & TECHNOLOGIES, INC. (US) 2000-11-21 US disclosed
WO-2000004870-A2 COMPOSITION FOR ENHANCING EPIDERMAL LIPID PRODUCTION BIOMED RESEARCH AND TECHNOLOGIES, INC. (US) 2000-02-03 WO disclosed
EP-0584374-B1 PEPTIDE WHICH INHIBITS PHOSPHOLIPASE C KYOWA HAKKO KOGYO KK (JP) 1997-09-24 EP disclosed
EP-0226304-B1 COMPOSITION CONTAINING A PENEM OR CARBAPENEM ANTIBIOTIC SANKYO COMPANY LIMITED (JP) 1991-08-28 EP disclosed
US-4859653-A Use of compositions of matter containing N-acylates of alpha aminoacids for the treatment of skin MORELLE JEAN V (FR) 1989-08-22 US disclosed
US-4757066-A Reduces renal toxicity SANKYO COMPANY LIMITED (JP) 1988-07-12 US disclosed
EP-0226304-A1 Composition containing a penem or carbapenem antibiotic SANKYO COMPANY LIMITED (JP) 1987-06-24 EP 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 (2 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-20250000948-A1 SOLID COMPOSITIONS COMPRISING A PEPTIDE OR A PROTEIN AND AN ACYLATED AMINO ACID NPPA, BCAT1, ANPEP ALDH1A1 4701/4885PLA2G2A 1852/4885PLA2G5 2191/4885
US-20240390433-A1 GENETICALLY MODIFIED BACILLUS SUBTILIS STRAIN AND USE AS A LIVE DELIVERY AND PRODUCTION SYSTEM BLVRB, GLB1, GUSB ALDH1A1 4757/4885PLA2G2A 155/4885PLA2G5 262/4885

“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.