SCHEMBL1344808

SCHEMBL1344808

CCC(C(=O)O)C(=O)OC(C)(C)C

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.39
MEN1 O00255 1/20 0.39
GAA P10253 1/20 0.39
CTSS P25774 3/20 0.38
CTSK P43235 3/20 0.38
CA2 P00918 3/20 0.35
MAPK1 P28482 1/20 0.35
SYK P43405 1/20 0.34
AAK1 Q2M2I8 1/20 0.33
LMNA P02545 1/20 0.33
CA1 P00915 2/20 0.32
CA7 P43166 1/20 0.32
DGAT1 O75907 1/20 0.32
NOS1 P29475 2/20 0.32
CYP1A2 P05177 1/20 0.32
CYP2C9 P11712 1/20 0.32
CYP2C19 P33261 1/20 0.32
HTT P42858 1/20 0.32
NOS3 P29474 1/20 0.32
NOS2 P35228 1/20 0.32

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
SCHEMBL28710632 1.00 KMT2A (0.39) KMT2AMEN1GAACTSSCTSK
Methylamine SCHEMBL28534491 0.96 KMT2A (0.37) KMT2AMEN1GAACTSSCTSK
SCHEMBL1344807 0.91 CTSK (0.36) KMT2AMEN1GAACTSSCTSK
SCHEMBL28173071 0.84 CTSS (0.33) KMT2AMEN1GAACTSSCTSK
SCHEMBL31604 0.83 CHRM1 (0.43) KMT2AMEN1GAACTSSCTSK
SCHEMBL2439297 0.83 HTT (0.40) KMT2AMEN1GAALMNACYP1A2
SCHEMBL19206295 0.83 KMT2A (0.34) KMT2AMEN1GAACTSSCTSK
SCHEMBL4477961 0.83 CA1 (0.42) KMT2AMEN1GAACTSSCTSK
SCHEMBL27969605 0.83 CTSK (0.33) KMT2AMEN1GAACTSSCTSK
SCHEMBL4864421 0.83 NOS1 (0.33) KMT2AMEN1GAACTSSCTSK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115876926-A Method for detecting BOC butyric acid in water and algae culture medium by using HPLC-MS/MS 贵州健安德科技有限公司 2023-03-31 CN claimed
CN-113273075-A Electrostatic machine system and method of operation C-莫蒂夫技术公司 2021-08-17 CN claimed
CN-115876926-B Method for detecting BOC butyric acid in water and algae culture medium by utilizing HPLC-MS/MS 贵州健安德科技有限公司 2025-09-23 CN disclosed
CN-115876926-B Method for detecting BOC butyric acid in water and algae culture medium by utilizing HPLC-MS/MS 贵州健安德科技有限公司 2025-09-23 CN disclosed
WO-2025098432-A1 mIDH1/NAMPT DUAL-TARGET INHIBITOR AND USE THEREOF 中国药科大学 2025-05-15 WO disclosed
CN-116217440-B Preparation method of sitagliptin key intermediate 浙江永太手心医药科技有限公司 2024-07-02 CN disclosed
CN-118063351-B Green synthesis of chiral beta amino acids using biological enzymes and immobilized aminotransferase used 北京元延医药科技股份有限公司 2024-06-28 CN disclosed
CN-118063351-A Green synthesis of chiral beta amino acids using biological enzymes and immobilized aminotransferase used 北京元延医药科技股份有限公司 2024-05-24 CN disclosed
CN-114940648-B Method for preparing malonic acid mono-tert-butyl ester by catalysis of strong acid resin 常州夏青科技有限公司 2023-11-21 CN disclosed
CN-111170991-B Antiproliferative compounds and methods of synthesis thereof 细胞基因公司 2023-10-31 CN disclosed
EP-3694503-B1 NOVEL SUBSTITUTED CYCLOBUTYLPYRIDINE AND CYCLOBUTYLPYRIMIDINE COMPOUNDS AS INDOLEAMINE 2,3-DIOXYGENASE (IDO) INHIBITORS MERCK SHARP & DOHME LLC (US) 2023-08-02 EP disclosed
US-20040198736-A1 Non-nucleoside reverse transcriptase inhibitors ROCHE PALO ALTO LLC 2004-10-07 US disclosed
WO-2004085406-A1 BENZYL-PYRIDAZINONS AS REVERSE TRANSCRIPTASE INHIBITORS F. HOFFMANN-LA ROCHE AG (CH) 2004-10-07 WO disclosed
US-20030225113-A1 Bicyclic heteroaromatic compounds MERCK SHARP & DOHME B.V. (NL) 2003-12-04 US disclosed
EP-1322651-A1 BICYCLIC HETEROAROMATIC COMPOUNDS Akzo Nobel N.V. (NL) 2003-07-02 EP disclosed
CN-1423638-A Oxazolyl hydroxamic acids as procollagen C-protease inhibitors PFIZER LTD (US) 2003-06-11 CN disclosed
WO-2002024703-A1 BICYCLIC HETEROAROMATIC COMPOUNDS AKZO NOBEL N.V. (NL) 2002-03-28 WO disclosed
CN-1014515-B Process for preparing nonaromatic fluoroallylamine as MAO inhibitor MERRELL DOW PHARMA (US) 1991-10-30 CN disclosed
CN-86108051-A NONAROMATIC FLUOROALLYLAMINE MAO INHIBITORS 1987-08-19 CN disclosed
US-3932121-A Process for the dyeing of modified polyester fibers HODOGAYA KAGAKU KOGYO KABUSHIKI KAISHA (JA) 1976-01-13 US 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-20030225113-A1 Bicyclic heteroaromatic compounds NR5A1, CYP19A1, FSHR KMT2A 1849/4885MEN1 3631/4885GAA 4343/4885
US-20040198736-A1 Non-nucleoside reverse transcriptase inhibitors POLR1A, POLR2A, POLR2E KMT2A 2836/4885MEN1 4616/4885GAA 602/4885

“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.