SCHEMBL4661763

SCHEMBL4661763

CC(O)(C(=O)O)c1cc2ccccc2[nH]1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.50
DAO P14920 2/20 0.50
MAPT P10636 1/20 0.50
HPGD P15428 1/20 0.50
SRD5A2 P31213 1/20 0.50
HSD17B10 Q99714 1/20 0.50
AHR P35869 1/20 0.49
FLT3 P36888 1/20 0.47
LMNA P02545 2/20 0.43
NPC1 O15118 2/20 0.43
RAB9A P51151 2/20 0.43
IDO1 P14902 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
SLC22A12 Q96S37 1/20 0.42
BRD4 O60885 1/20 0.42
DDO Q99489 1/20 0.42
TSHR P16473 1/20 0.42
PDGFRB P09619 1/20 0.42
PDGFRA P16234 1/20 0.42
TP53 P04637 1/20 0.42

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
SCHEMBL12827006 0.85 KDM4E (0.51) KDM4EDAOMAPTHPGDSRD5A2
SCHEMBL31070307 0.83 KDM4E (0.53) KDM4EDAOMAPTHPGDSRD5A2
SCHEMBL28525518 0.82 KDM4E (0.49) KDM4EDAOMAPTHPGDSRD5A2
SCHEMBL6205544 0.82 KDM4E (0.49) KDM4EDAOMAPTHPGDSRD5A2
SCHEMBL518792 0.81 KDM4E (0.47) KDM4EDAOMAPTHPGDSRD5A2
SCHEMBL5692312 0.80 AHR (0.56) KDM4EDAOMAPTHPGDSRD5A2
SCHEMBL9577471 0.79 KDM4E (0.49) KDM4EDAOMAPTHPGDSRD5A2
SCHEMBL31078913 0.78 KDM4E (0.47) KDM4EDAOMAPTHPGDSRD5A2
SCHEMBL15641062 0.77 IDO1 (0.48) KDM4EDAOMAPTHPGDSRD5A2
SCHEMBL399327 0.76 AHR (0.50) KDM4EDAOMAPTHPGDSRD5A2

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 28 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
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-118956634-B Lactobacillus johnsonii and application of composition thereof in relieving ulcerative colitis 南昌大学 2025-02-28 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
CN-118956634-A Lactobacillus johnsonii and application of composition thereof in relieving ulcerative colitis 南昌大学 2024-11-15 CN disclosed
CN-118667726-B Cheese bacillus WNT9-3 and application thereof 内蒙古农业大学 2024-11-08 CN disclosed
CN-118685296-A Use of bifidobacterium longum exopolysaccharides for promoting production of microbial active metabolites 中山大学 2024-09-24 CN disclosed
EP-3626815-A1 STRAIN OF MICROORGANISM CLONOSTACHYS ROSEA F. CATENULATA AS A BIOFUNGICIDE, PLANT GROWTH STIMULANT AND METABOLITE PRODUCER FOR AGRICULTURAL USE Obshchestvo S Ogranichennoy Otvetsvennostyu "Ekogen" (RU) 2020-03-25 EP disclosed
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 disclosed
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 disclosed
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 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 KDM4E 3354/4885DAO 370/4885MAPT 3/4885

“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.