SCHEMBL4424144

SCHEMBL4424144

C=CC(=O)CCc1ccccc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR52 Q9Y2T5 1/20 0.59
KEAP1 Q14145 1/20 0.59
ALDH1A1 P00352 2/20 0.55
FFAR1 O14842 2/20 0.55
MAPT P10636 3/20 0.53
HTT P42858 1/20 0.53
HDAC2 Q92769 2/20 0.52
HDAC8 Q9BY41 2/20 0.52
HDAC6 Q9UBN7 2/20 0.52
TDP1 Q9NUW8 1/20 0.52
HDAC1 Q13547 3/20 0.50
SMN1; SMN2 Q16637 2/20 0.50
HDAC3 O15379 1/20 0.50
MAPK1 P28482 1/20 0.50
ADRA1A P35348 1/20 0.50
HDAC4 P56524 1/20 0.50
SLC6A3 Q01959 1/20 0.50
HDAC7 Q8WUI4 1/20 0.50
HDAC10 Q969S8 1/20 0.50
HDAC11 Q96DB2 1/20 0.50

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
Hydrochloric Acid SCHEMBL27720366 0.98 GPR52 (0.58) GPR52KEAP1ALDH1A1FFAR1MAPT
SCHEMBL8733598 0.88 HDAC1 (0.62) KEAP1MAPTHDAC2HDAC8HDAC6
SCHEMBL24504176 0.86 MAPT (0.61) MAPTHDAC2HDAC8HDAC6TDP1
SCHEMBL13310793 0.85 THRB (0.50) GPR52FFAR1HDAC2HDAC8HDAC6
SCHEMBL13892460 0.85 MAPT (0.65) MAPTHDAC2HDAC8HDAC6HDAC1
SCHEMBL27908866 0.84 FFAR1 (0.49) GPR52KEAP1FFAR1MAPTGAA
SCHEMBL17897411 0.83 FFAR1 (0.52) GPR52FFAR1HDAC2HDAC8
SCHEMBL16812840 0.83 THRB (0.43) GPR52KEAP1FFAR1KMT2A
SCHEMBL15272414 0.82 ESR1 (0.50) ALDH1A1MAPTHDAC2HDAC8TDP1
SCHEMBL2322246 0.81 KEAP1 (0.61) GPR52KEAP1ALDH1A1FFAR1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2847318-A1 PESTICIDAL FLAVOBACTERIUM STRAIN AND BIOACTIVE COMPOSITIONS, METABOLITES AND USES Marrone Bio Innovations, Inc. (US) 2015-03-18 EP claimed
WO-2013138398-A1 PESTICIDAL FLAVOBACTERIUM STRAIN AND BIOACTIVE COMPOSITIONS, METABOLITES AND USES MARRONE BIO INNOVATIONS, INC. (US) 2013-09-19 WO claimed
CN-1028098-C Preparation of amino ketone compound MONSANTO CO (US) 1995-04-05 CN claimed
EP-4596230-A1 MULTILAYER STRUCTURE AND METHOD FOR PRODUCING SAME, AUTOMOBILE PART, AIRCRAFT PART, AND DAMPING MATERIAL FOR CARBON-FIBER-REINFORCED PLASTIC Mitsubishi Chemical Corporation (JP) 2025-08-06 EP disclosed
US-20250178327-A1 MULTILAYER STRUCTURE AND METHOD FOR PRODUCING SAME, AUTOMOBILE PART, AIRCRAFT PART, AND DAMPING MATERIAL FOR CARBON-FIBER-REINFORCED PLASTIC MITSUBISHI CHEMICAL CORPORATION (JP) 2025-06-05 US disclosed
CN-119731020-A Multilayer structure, method for producing same, automobile component, aircraft component, and vibration-resistant material for carbon fiber reinforced plastic 三菱化学株式会社 2025-03-28 CN disclosed
CN-119638660-A Preparation method of 3, 4-dihydropyran derivative 华侨大学 2025-03-18 CN disclosed
WO-2024157637-A1 LAMINATE AND IMAGE DISPLAY DEVICE 株式会社ダイセル 2024-08-02 WO disclosed
WO-2024135086-A1 PHOTOCURABLE COMPOSITION, UNDERCOAT LAYER, LAMINATE AND DISPLAY DEVICE 株式会社ダイセル 2024-06-27 WO disclosed
CN-118125919-A Preparation method of conjugated triene compound 华南理工大学 2024-06-04 CN disclosed
WO-2024071139-A1 MULTILAYER STRUCTURE AND METHOD FOR PRODUCING SAME, AUTOMOBILE PART, AIRCRAFT PART, AND DAMPING MATERIAL FOR CARBON-FIBER-REINFORCED PLASTIC 三菱ケミカル株式会社 2024-04-04 WO disclosed
EP-1723116-A2 TETRAHYDROQUINOLINONES AND THEIR USE AS ANTAGONISTS OF METABOTROPIC GLUTAMATE RECEPTORS Merz Pharma GmbH & Co. KGaA (DE) 2006-11-22 EP disclosed
CN-1730476-A Aromatic amine ketone compounds, its synthetic method, the pharmaceutical composition that contains it and purposes INST MATERIA MEDICA CAMS (CN) 2006-02-08 CN disclosed
EP-1615636-A1 BICYCLIC COMPOUNDS AS NR2B RECEPTOR ANTAGONISTS PFIZER INC. (US) 2006-01-18 EP disclosed
WO-2005082856-A2 TETRAHYDROQUINOLINONES AND THEIR USE AS ANTAGONISTS OF METABOTROPIC GLUTAMATE RECEPTORS MERZ PHARMA GMBH & CO. KGAA (DE) 2005-09-09 WO disclosed
US-20050197361-A1 Specific binding is extremely high; low toxicity; high degree of activity; 2-(5-m-Tolyl-thiazol-2-yl )-7,8-dihydro-6H-quinolin-5-one, acute and/or chronic neurological disorders MERZ PHARMA GMBH & CO. KGAA (DE) 2005-09-08 US disclosed
WO-2004089366-A1 BICYCLIC COMPOUNDS AS NR2B RECEPTOR ANTAGONISTS PFIZER JAPAN, INC. (JP) 2004-10-21 WO disclosed
US-20040204409-A1 Bicyclic compounds as NR2B receptor antagonists ANDO KAZUO (JP) 2004-10-14 US disclosed
CN-1140708-A Synthetic method for lisinopril WUZHOU PHARMACEUTICAL FACTORY (CN) 1997-01-22 CN disclosed
US-4003911-A ANTISECRETORY AGENTS, OXYTOCICS, BRONCHODILATORS, PLASTICIZERS E. I. DU PONT DE NEMOURS AND COMPANY (US) 1977-01-18 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-20040204409-A1 Bicyclic compounds as NR2B receptor antagonists GRIN1, GRIN2B, GRIN2A GPR52 68/4885KEAP1 2753/4885ALDH1A1 1871/4885
US-20050197361-A1 Specific binding is extremely high; low toxicity; high degree of activity; 2-(5-m-Tolyl-thiazol-2-yl )-7,8-dihydro-6H-quinolin-5-one, acute and/or chronic neurological disorders GRM5, GRIK5, GRIN2C GPR52 55/4885KEAP1 258/4885ALDH1A1 1519/4885

“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.