SCHEMBL7208899

SCHEMBL7208899

COC(=O)C(C(=O)O)C(C)(C)C

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.41
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
CA14 Q9ULX7 3/20 0.35
KMT2A Q03164 3/20 0.35
CA12 O43570 2/20 0.35
MEN1 O00255 1/20 0.33
GAA P10253 1/20 0.33
ZDHHC7 Q9NXF8 1/20 0.32
ALDH1A1 P00352 2/20 0.31
MAPT P10636 1/20 0.31
PTGS1 P23219 1/20 0.31
MME P08473 1/20 0.31
FOLH1 Q04609 1/20 0.30
DGAT1 O75907 1/20 0.30
SLC1A3 P43003 1/20 0.30
SLC1A2 P43004 1/20 0.30
SLC1A1 P43005 1/20 0.30

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
SCHEMBL2600065 0.87 SMN1; SMN2 (0.46) SMN1; SMN2CA1CA2CA14KMT2A
SCHEMBL14827564 0.80 SMN1; SMN2 (0.41) SMN1; SMN2CA1CA2CA14KMT2A
SCHEMBL635059 0.78 KMT2A (0.40) CA1CA2CA14KMT2ACA12
SCHEMBL635058 0.78 KMT2A (0.40) CA1CA2CA14KMT2ACA12
SCHEMBL7528046 0.78 SMN1; SMN2 (0.39) SMN1; SMN2CA1CA2CA14KMT2A
SCHEMBL897666 0.78 ALDH1A1 (0.39) ALDH1A1MAPTPTGS1
SCHEMBL7212483 0.78 CA1 (0.38) SMN1; SMN2CA1CA2KMT2AMEN1
SCHEMBL3212385 0.76 ALDH1A1 (0.40) CA2KMT2AMEN1GAAALDH1A1
SCHEMBL526639 0.76 DGAT1 (0.41) SMN1; SMN2CA1CA2CA14KMT2A
SCHEMBL27926275 0.76 KDM4E (0.33) SMN1; SMN2CA1CA2KMT2AALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115108933-B Synthesis method of lacosamide 上药康丽(常州)药业有限公司 2023-09-29 CN claimed
CN-113461679-B Synthesis of benzazepine isatin compound 石药集团中奇制药技术(石家庄)有限公司 2022-09-30 CN claimed
CN-113461679-A Synthesis of benzazepine isatin compound 石药集团中奇制药技术(石家庄)有限公司 2021-10-01 CN claimed
EP-3328914-A1 BLOCKED POLYISOCYANATE COMPOSITION BASED ON PENTAMETHYLENE 1,5-DIISOCYANATE Covestro Deutschland AG (DE) 2018-06-06 EP claimed
WO-2017021150-A1 BLOCKED POLYISOCYANATE COMPOSITION BASED ON PENTAMETHYLENE 1,5-DIISOCYANATE COVESTRO DEUTSCHLAND AG (DE) 2017-02-09 WO claimed
US-6613934-B1 Enzymatic partial hydrolysis of a diester of malonic acid DEGUSSA AG (DE) 2003-09-02 US claimed
US-12037444-B2 Phenolic resin binder with reduced formaldehyde content ASK CHEMICALS GMBH (DE) 2024-07-16 US disclosed
CN-115108933-B Synthesis method of lacosamide 上药康丽(常州)药业有限公司 2023-09-29 CN disclosed
CN-115108933-B Synthesis method of lacosamide 上药康丽(常州)药业有限公司 2023-09-29 CN disclosed
CN-109689647-B Bicyclic heteroaryl substituted compounds 百时美施贵宝公司 2023-01-20 CN disclosed
CN-113461679-B Synthesis of benzazepine isatin compound 石药集团中奇制药技术(石家庄)有限公司 2022-09-30 CN disclosed
CN-114630823-A GLP-1R modulating compounds 吉利德科学公司 2022-06-14 CN disclosed
CN-113461679-A Synthesis of benzazepine isatin compound 石药集团中奇制药技术(石家庄)有限公司 2021-10-01 CN disclosed
WO-2017021150-A1 BLOCKED POLYISOCYANATE COMPOSITION BASED ON PENTAMETHYLENE 1,5-DIISOCYANATE COVESTRO DEUTSCHLAND AG (DE) 2017-02-09 WO disclosed
US-9499469-B2 Production method of ketomalonic acid compound IHARA CHEMICAL INDUSTRY CO., LTD. (JP) 2016-11-22 US disclosed
US-20160194268-A1 PRODUCTION METHOD OF KETOMALONIC ACID COMPOUND IHARA CHEMICAL INDUSTRY CO., LTD. (JP) 2016-07-07 US disclosed
US-6613934-B1 Enzymatic partial hydrolysis of a diester of malonic acid DEGUSSA AG (DE) 2003-09-02 US disclosed
EP-0812819-B1 Enantiomer-enriched tertiary hydrocarbonrest-substituted malonic acid ester and the preparation DEGUSSA (DE) 2001-11-28 EP disclosed
US-5831119-A Process for the preparation of aminoacetic acids with a tertiary hydrocarbon radical in the α-position, or their nitriles HUELS AKTIENGESELLSCHAFT (DE) 1998-11-03 US disclosed
EP-0812819-A2 Enantiomer-enriched tertiary hydrocarbonrest-substituted malonic acid ester and the preparation HÜLS AKTIENGESELLSCHAFT (DE) 1997-12-17 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 (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-20160194268-A1 PRODUCTION METHOD OF KETOMALONIC ACID COMPOUND CA6, ME1, SI SMN1; SMN2 3342/4885CA1 105/4885CA2 43/4885

“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.