SCHEMBL1332798

SCHEMBL1332798

O=C(O)C(O)Cc1cc2ccccc2[nH]1

nearest known ligand 0.55

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ADAMTS4 O75173 1/20 0.55
LOXL2 Q9Y4K0 1/20 0.50
MTNR1A P48039 1/20 0.49
MTNR1B P49286 1/20 0.49
KDM4E B2RXH2 2/20 0.49
MAPT P10636 1/20 0.49
DAO P14920 1/20 0.49
HPGD P15428 1/20 0.49
SRD5A2 P31213 1/20 0.49
HSD17B10 Q99714 1/20 0.49
TSHR P16473 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
PIN1 Q13526 2/20 0.47
FLT3 P36888 1/20 0.46
IDO1 P14902 1/20 0.45
PTPRA P18433 1/20 0.45
ALDH1A1 P00352 1/20 0.44
GAA P10253 1/20 0.44
MAPK1 P28482 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
SCHEMBL29396939 1.00 ADAMTS4 (0.55) ADAMTS4LOXL2MTNR1AMTNR1BKDM4E
SCHEMBL29379275 1.00 ADAMTS4 (0.55) ADAMTS4LOXL2MTNR1AMTNR1BKDM4E
SCHEMBL5172404 1.00 ADAMTS4 (0.55) ADAMTS4LOXL2MTNR1AMTNR1BKDM4E
SCHEMBL30620144 0.93 ADAMTS4 (0.50) ADAMTS4LOXL2MTNR1AMTNR1BKDM4E
SCHEMBL38659080 0.89 ADAMTS4 (0.49) ADAMTS4LOXL2MTNR1AMTNR1BKDM4E
SCHEMBL30011822 0.87 ADAMTS4 (0.46) ADAMTS4LOXL2MTNR1AMTNR1BKDM4E
Indole SCHEMBL31299797 0.86 ADAMTS4 (0.45) ADAMTS4LOXL2MTNR1AMTNR1BKDM4E
SCHEMBL29388323 0.86 SMN1; SMN2 (0.74) KDM4EMAPTTSHRSMN1; SMN2GAA
SCHEMBL45382 0.83 ALPI (0.54) ADAMTS4LOXL2MTNR1AMTNR1BKDM4E
SCHEMBL4393088 0.83 ALPI (0.54) ADAMTS4LOXL2MTNR1AMTNR1BKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117969859-B Metabolic biomarker for polycystic ovary syndrome and application thereof 山东大学 2024-09-06 CN claimed
CN-117969859-A Metabolic biomarker for polycystic ovary syndrome and application thereof 山东大学 2024-05-03 CN claimed
EP-1501503-B1 SUBSTANTIALLY PURE SOLID FORM OF THE ENOL TAUTOMER OF 3-INDOLYPYRUVIC ACID FOR USE IN THE TREATMENT OF CENTRAL NERVOUS SYSTEM DISTURBANCES POLIFARMA SPA (IT) 2008-12-24 EP claimed
EP-1326993-B1 PRODUCTION OF ALPHA-HYDROXY-CARBOXYLIC ACIDS USING A COUPLED ENZYME SYSTEM EXCELSYN MOLECULAR DEV LTD (GB) 2007-05-23 EP claimed
US-20050208125-A1 Substantially pure solid form of the enol tautomer of 3-indolypyruvic acid for use in the treatmetn of central nervous system disturbances POLIFARMA S.P.A. (IT) 2005-09-22 US claimed
EP-1501503-A1 SUBSTANTIALLY PURE SOLID FORM OF THE ENOL TAUTOMER OF 3-INDOLYPYRUVIC ACID FOR USE IN THE TREATMENT OF CENTRAL NERVOUS SYSTEM DISTURBANCES POLIFARMA S.p.A. (IT) 2005-02-02 EP claimed
US-20040053382-A1 Production of alpha-hydroxy-carboxylic acids using a coupled enzyme system EXCELSYN MOLECULAR DEVELOPMENT LIMITED (GB) 2004-03-18 US claimed
WO-2003094914-A1 SUBSTANTIALLY PURE SOLID FORM OF THE ENOL TAUTOMER OF 3-INDOLYLPYRUVIC ACID FOR USE IN THE TREATMENT OF CENTRAL NERVOUS SYSTEM DISTURBANCES POLIFARMA S.P.A. (IT) 2003-11-20 WO claimed
EP-1326993-A2 PRODUCTION OF g(a)-HYDROXY-CARBOXYLIC ACIDS USING A COUPLED ENZYME SYSTEM PCBU Services, Inc. (US) 2003-07-16 EP claimed
WO-2002033110-A2 PRODUCTION OF α-HYDROXY-CARBOXYLIC ACIDS USING A COUPLED ENZYME SYSTEM PCBU SERVICES, INC. (US) 2002-04-25 WO claimed
US-4190585-A 2,3-DIHYDRO-2,5-FURAN DICARBOXYLIC ACID, PHENYL HYDRAZINE, SULFURIC ACID LONZA LTD. (CH) 1980-02-26 US claimed
CN-119812333-A Dispersing agent composition, pole piece and battery 深圳市德方创域新能源科技有限公司 2025-04-11 CN disclosed
CN-119586585-A Application of bifidobacterium longum CCFM1218 for relieving intestinal barrier injury of gliadin combined high-fat diet 江南大学 2025-03-11 CN disclosed
CN-119421888-A Mammalian milk-derived peptides having antimicrobial activity 马楚比尔斯公司 2025-02-11 CN disclosed
CN-118956635-A Lactobacillus johnsonii for relieving ulcerative colitis and application thereof 南昌大学 2024-11-15 CN disclosed
WO-2003094914-A1 SUBSTANTIALLY PURE SOLID FORM OF THE ENOL TAUTOMER OF 3-INDOLYLPYRUVIC ACID FOR USE IN THE TREATMENT OF CENTRAL NERVOUS SYSTEM DISTURBANCES POLIFARMA S.P.A. (IT) 2003-11-20 WO disclosed
US-4782020-A Process for the continuous enzymatic conversion of alpha-hydrocarboxylic acids into the corresponding optically active alpha-aminocarboxylic acids DEGUSSA AKTIENGESELLSCHAFT (DE) 1988-11-01 US disclosed
US-4190585-A 2,3-DIHYDRO-2,5-FURAN DICARBOXYLIC ACID, PHENYL HYDRAZINE, SULFURIC ACID LONZA LTD. (CH) 1980-02-26 US disclosed
US-4190585-A 2,3-DIHYDRO-2,5-FURAN DICARBOXYLIC ACID, PHENYL HYDRAZINE, SULFURIC ACID LONZA LTD. (CH) 1980-02-26 US disclosed
US-4190585-A 2,3-DIHYDRO-2,5-FURAN DICARBOXYLIC ACID, PHENYL HYDRAZINE, SULFURIC ACID LONZA LTD. (CH) 1980-02-26 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 (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-20050208125-A1 Substantially pure solid form of the enol tautomer of 3-indolypyruvic acid for use in the treatmetn of central nervous system disturbances NLN, PYGB, MAPT ADAMTS4 2228/4885LOXL2 3938/4885MTNR1A 100/4885

“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.