SCHEMBL3844892

SCHEMBL3844892

CCCCCCCCC=CCCCCCCC(C)(C)C(N)=O

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FAAH O00519 4/20 0.61
SOAT1 P35610 2/20 0.61
CYP1A2 P05177 2/20 0.61
CYP2C19 P33261 2/20 0.61
KMT2A Q03164 2/20 0.61
ACLY P53396 1/20 0.61
MEN1 O00255 1/20 0.61
TP53 P04637 1/20 0.61
CYP3A4 P08684 1/20 0.61
KDM4E B2RXH2 2/20 0.56
CNR1 P21554 1/20 0.53
TERT O14746 3/20 0.52
PTPN1 P18031 3/20 0.52
PPARG P37231 3/20 0.52
PPARD Q03181 3/20 0.52
PPARA Q07869 3/20 0.52
MAPT P10636 2/20 0.52
BLM P54132 2/20 0.52
HSD17B10 Q99714 2/20 0.52
FABP4 P15090 2/20 0.52

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
SCHEMBL119424 1.00 FAAH (0.61) FAAHSOAT1CYP1A2CYP2C19KMT2A
SCHEMBL18248559 1.00 FAAH (0.61) FAAHSOAT1CYP1A2CYP2C19KMT2A
SCHEMBL10805141 1.00 FAAH (0.61) FAAHSOAT1CYP1A2CYP2C19KMT2A
SCHEMBL3844890 1.00 FAAH (0.61) FAAHSOAT1CYP1A2CYP2C19KMT2A
SCHEMBL18248594 0.95 KDM4E (0.65) FAAHSOAT1CYP1A2CYP2C19KMT2A
Propylamine SCHEMBL28274365 0.93 FAAH (0.54) FAAHSOAT1CYP1A2CYP2C19KMT2A
Propylamine SCHEMBL28834642 0.93 FAAH (0.54) FAAHSOAT1CYP1A2CYP2C19KMT2A
Oleic Acid SCHEMBL9308139 0.91 PPARG (0.70) FAAHCYP1A2CYP2C19KMT2ACYP3A4
SCHEMBL373955 0.88 FDPS (0.47)
SCHEMBL547320 0.88 FDPS (0.47)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240398751-A1 Methods of treating or reducing symptoms of stimulant dependency (addiction) via combination therapy with vaccine/antibodies and 5ht1/5ht2, SERT and glutamate allosteric modulators HELDRETH JR DAVID ALAN (US) 2024-12-05 US claimed
US-20240398750-A1 Methods of treating or reducing symptoms of anxiety, depression, attention deficiency (ADD), attention deficient hyperactivity (ADHD), obsessive compulsive (OCD), Bipolar disorder, and related disorders/conditions via combination therapy with vaccine/antibodies and 5ht1/5ht2, SERT and other allosteric modulators. HELDRETH JR DAVID ALAN (US) 2024-12-05 US claimed
US-20240325343-A1 Methods of reducing symptoms of the ingestion of drugs such as cannabis or 5ht2 agonists via applications with 5ht1/2, CB1, GLP-1 allosteric modulators where the method of delivery/formulation selected from: Inhaler, nebulizer, intravenously, intramuscularly, injection, capsules, tablets, pills. HELDRETH JR DAVID ALAN (US) 2024-10-03 US claimed
US-20240325345-A1 Methods of increasing effects of the ingestion of drugs such as cannabis or 5ht2 agonists via applications with 5ht1/2, CB1, opiate allosteric modulators as/in foods, beverages, vaporizer, smoking and supplement products/formulations. HELDRETH JR DAVID ALAN (US) 2024-10-03 US claimed
US-20240325342-A1 Methods of treating or reducing symptoms of opiate dependency (addiction) via combination therapy with vaccine/antibodies and 5ht1/5ht2, SERT and opiate allosteric modulators HELDRETH JR DAVID ALAN (US) 2024-10-03 US claimed
US-20240325344-A1 Methods of reducing symptoms of the ingestion of drugs such as cannabis or 5ht2 agonists via applications with 5ht1/2, CB1, GLP-1 allosteric modulators as/in foods, beverages, vaporizer, smoking and supplement products/formulations. HELDRETH JR DAVID ALAN (US) 2024-10-03 US claimed
US-20240299341-A1 Methods of treating or reducing symptoms of nicotine dependency (addiction) such as tobacco-use (smoking, vaping, sublingual, oral) and/or tobacco smoking cessation via combination therapy with allosteric modulators and phenethylamines. HELDRETH JR DAVID ALAN (US) 2024-09-12 US claimed
US-20240269107-A1 Methods of treating or reducing symptoms of brain cancer such as glioma and glioblastoma via combination therapy with allosteric modulators and phenethylamines. HELDRETH JR DAVID ALAN (US) 2024-08-15 US claimed
CN-111636068-B Cleaning agent and preparation method thereof 上海未来企业股份有限公司 2022-08-16 CN claimed
CN-114761637-A Non-rewetting O/W (oil in water) emulsification systems for hydrophobic compounds 有机点击股份公司 2022-07-15 CN claimed
EP-3297621-A1 A METHOD FOR TREATING PERIPHERAL INFLAMMATORY DISEASE Dublin City University (IE) 2018-03-28 EP claimed
WO-2016185025-A1 A METHOD FOR TREATING PERIPHERAL INFLAMMATORY DISEASE DUBLIN CITY UNIVERSITY (IE) 2016-11-24 WO claimed
CN-102396519-A Reptile killing aerosol WEI JIANG 2012-04-04 CN claimed
EP-1037677-A2 MEDICAL DEVICES WITH IMPROVED PROPERTIES Intella Interventional Systems, Inc. (US) 2000-09-27 EP claimed
CN-1262601-A Synergistic antimicrobial compositions containing dimethylamide of carboxylic acid with mixture of 2-(thiocyanomethylthio) benzothiazole and methylene-bis (thiocyanate) BUCKMAN LABOR INC (US) 2000-08-09 CN claimed
EP-0994651-A1 SYNERGISTIC ANTIMICROBIAL COMPOSITIONS CONTAINING A DIMETHYLAMIDE OF A CARBOXYLIC ACID WITH A MIXTURE OF 2-(THIOCYANOMETHYLTHIO) BENZOTHIAZOLE AND METHYLENE-BIS(THIOCYANATE) BUCKMAN LABORATORIES INTERNATIONAL, INC. (US) 2000-04-26 EP claimed
WO-1999029353-A2 MEDICAL DEVICES WITH IMPROVED PROPERTIES INTELLA INTERVENTIONAL SYSTEMS, INC. (US) 1999-06-17 WO claimed
WO-1999002037-A1 SYNERGISTIC ANTIMICROBIAL COMPOSITIONS CONTAINING A DIMETHYLAMIDE OF A CARBOXYLIC ACID WITH A MIXTURE OF 2-(THIOCYANOMETHYLTHIO) BENZOTHIAZOLE AND METHYLENE-BIS(THIOCYANATE) BUCKMAN LABORATORIES INTERNATIONAL, INC. (US) 1999-01-21 WO claimed
CN-111636068-B Cleaning agent and preparation method thereof 上海未来企业股份有限公司 2022-08-16 CN disclosed
US-3954977-A EMULSIFIERS AMERICAN HOME PRODUCTS CORPORATION (US) 1976-05-04 US disclosed