SCHEMBL428458

SCHEMBL428458

CCC(C)C(NC(C)=O)C(=O)O

nearest known ligand 0.66

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.66
L3MBTL1 Q9Y468 1/20 0.56
KMT2A Q03164 3/20 0.49
MEN1 O00255 2/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
FPR2 P25090 3/20 0.49
ATM Q13315 1/20 0.49
CA2 P00918 3/20 0.46
CA1 P00915 2/20 0.46
ENPEP Q07075 2/20 0.44
MAPK1 P28482 1/20 0.44
CYP2C9 P11712 1/20 0.44
CYP2C19 P33261 1/20 0.44
MME P08473 1/20 0.44
ACE P12821 1/20 0.44
CPA1 P15085 1/20 0.44
ACE2 Q9BYF1 1/20 0.44

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
SCHEMBL359065 1.00 ALDH1A1 (0.66) ALDH1A1L3MBTL1KMT2AMEN1SMN1; SMN2
SCHEMBL359064 1.00 ALDH1A1 (0.66) ALDH1A1L3MBTL1KMT2AMEN1SMN1; SMN2
SCHEMBL7775372 1.00 ALDH1A1 (0.66) ALDH1A1L3MBTL1KMT2AMEN1SMN1; SMN2
SCHEMBL6026558 1.00 ALDH1A1 (0.66) ALDH1A1L3MBTL1KMT2AMEN1SMN1; SMN2
SCHEMBL6026559 1.00 ALDH1A1 (0.66) ALDH1A1L3MBTL1KMT2AMEN1SMN1; SMN2
SCHEMBL9502850 1.00 ALDH1A1 (0.66) ALDH1A1L3MBTL1KMT2AMEN1SMN1; SMN2
SCHEMBL15692297 0.92 ALDH1A1 (0.58) ALDH1A1L3MBTL1KMT2AMEN1SMN1; SMN2
SCHEMBL9073718 0.87 ALDH1A1 (0.56) ALDH1A1L3MBTL1KMT2AMEN1SMN1; SMN2
SCHEMBL9073717 0.87 ALDH1A1 (0.56) ALDH1A1L3MBTL1KMT2AMEN1SMN1; SMN2
SCHEMBL10866724 0.86 ALDH1A1 (0.59) ALDH1A1L3MBTL1KMT2AMEN1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12503719-B2 Metabolomic characterization of microorganisms LEWIS IAN ANDREW (CA) 2025-12-23 US claimed
US-12076432-B2 Method of repairing oxidatively treated hair CONOPCO, INC. (US) 2024-09-03 US claimed
CN-115894143-B Palladium catalyzed double ligand unguided preparation method for deuterated aromatic compound 宁波萃英化学技术有限公司 2024-05-28 CN claimed
WO-2024030909-A1 BIOMARKERS OF AMINO ACID COMPOSITION TREATMENT RESPONSE IN LONG COVID AXCELLA HEALTH INC. (US) 2024-02-08 WO claimed
WO-2024026307-A1 BIOMARKER FOR LONG COVID AND FATIGUE AXCELLA HEALTH INC. (US) 2024-02-01 WO claimed
US-20230390346-A1 PROBIOTIC BACILLUS COMPOSITIONS AND METHODS OF USE BIOMEDIT, LLC 2023-12-07 US claimed
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
EP-4216726-A1 PROBIOTIC BACILLUS COMPOSITIONS AND METHODS OF USE Biomedit, LLC (US) 2023-08-02 EP claimed
CN-116507349-A Probiotic bacillus compositions and methods of use 生物编辑有限责任公司 2023-07-28 CN claimed
EP-3967703-B1 CYCLIC PEPTIDE, CELL SCAFFOLD MATERIAL, CELL SEPARATION MATERIAL AND CULTURE MEDIUM FUJIFILM CORP (JP) 2023-07-26 EP claimed
US-20060063827-A1 Systemic administration of therapeutic amino acids and N-acetylamino acids YU RUEY J 2006-03-23 US claimed
EP-1570840-A2 TOPICAL COMPOSITION COMPRISING N-ACETYLALDOSAMINES OR N-ACETYLAMINO ACIDS Yu, Ruey J., Dr. (US) 2005-09-07 EP claimed
US-20050171194-A1 Enlargement of mucocutaneous or cutaneous organs and sites with topical compositions YU RUEY J (US) 2005-08-04 US claimed
US-6524593-B1 Alleviate or improve various cosmetic conditions and dermatological disorders, skin, hair, nails TRISTRATA, INC. 2003-02-25 US claimed
US-6159485-A COSMETICS; SKIN DISORDERS YUGENIC LIMITED PARTNERSHIP (US) 2000-12-12 US claimed
WO-2000040217-B1 TOPICAL COMPOSITION COMPRISING N-ACETYLALDOSAMINES OR N-ACETYLAMINO ACIDS YUGENIC LIMITED PARTNERSHIP (US) 2000-10-05 WO claimed
US-5902826-A WATER SOLUBLE DIAMINE-PLATINUM (IV) COMPLEX; SIDE EFFECT REDUCTION, WATER SOLUBLE, TREATMENT OF MALIGNANT TUMORS SS PHARMACEUTICAL CO., LTD. (JP) 1999-05-11 US claimed
EP-0864578-A2 Platinum (IV) complex and pharmaceutical composition comprising the same SS PHARMACEUTICAL CO., LTD. (JP) 1998-09-16 EP claimed
US-5519000-A OLIGOPEPTIDE CENTECOR, INC. (US) 1996-05-21 US claimed
WO-1995026744-A1 TUMOR NECROSIS FACTOR INHIBITORS CENTOCOR, INC. (US) 1995-10-12 WO claimed