SCHEMBL67219

SCHEMBL67219

O=C(O)C(c1ccccc1)C1CCCCC1

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR1E P28566 3/20 0.63
S1PR3 Q99500 3/20 0.63
LMNA P02545 3/20 0.63
MEN1 O00255 2/20 0.63
KMT2A Q03164 2/20 0.63
MAPT P10636 1/20 0.63
CHRM3 P20309 4/20 0.60
CYP3A4 P08684 3/20 0.54
CYP1A2 P05177 2/20 0.54
CYP2D6 P10635 2/20 0.54
TSHR P16473 2/20 0.54
CHRM2 P08172 1/20 0.54
HTR1A P08908 1/20 0.54
ADRA2A P08913 1/20 0.54
CHRM1 P11229 1/20 0.54
DRD1 P21728 1/20 0.54
SLC6A2 P23975 1/20 0.54
ADRA1A P35348 1/20 0.54
OPRM1 P35372 1/20 0.54
DRD3 P35462 1/20 0.54

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
SCHEMBL12531975 1.00 HTR1E (0.63) HTR1ES1PR3LMNAMEN1KMT2A
Hydrochloric Acid SCHEMBL11526873 0.98 HTR1E (0.61) HTR1ES1PR3LMNAMEN1KMT2A
SCHEMBL28622389 0.98 HTR1E (0.65) HTR1ES1PR3LMNAMEN1KMT2A
SCHEMBL69127 0.98 HTR1E (0.65) HTR1ES1PR3LMNAMEN1KMT2A
SCHEMBL67619 0.94 HTR1E (0.60) HTR1ES1PR3LMNAMEN1KMT2A
SCHEMBL66920 0.90 LMNA (0.54) HTR1ES1PR3LMNAMEN1KMT2A
SCHEMBL4461851 0.90 HTR1E (0.53) HTR1ES1PR3LMNAMEN1KMT2A
SCHEMBL193456 0.89 HTR1E (0.63) HTR1ES1PR3LMNAMEN1KMT2A
Hydrochloric Acid SCHEMBL11359974 0.88 LMNA (0.53) HTR1ES1PR3LMNAMEN1KMT2A
SCHEMBL9780781 0.87 HTR1E (0.61) HTR1ES1PR3LMNAMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116836081-A Ether epoxy toughening agent and preparation method and application thereof 中国林业科学研究院林产化学工业研究所 2023-10-03 CN claimed
EP-2718281-B1 COMPOUNDS HAVING MUSCARINIC RECEPTOR ANTAGONIST AND BETA2 ADRENERGIC RECEPTOR AGONIST ACTIVITY CHIESI FARMA SPA (IT) 2015-09-09 EP claimed
CN-1750820-A Thiazole and oxazole derivatives which modulate PPAR activity WARNER LAMBERT CO (US) 2006-03-22 CN claimed
EP-0234400-A1 Esters of N-alkyl-nortropines and their quaternary derivatives having anti-bronchospastic activity, process for their preparation and pharmaceutical compositions containing them Laboratori Guidotti S.p.A. (IT) 1987-09-02 EP claimed
EP-4249470-B1 METHOD FOR PREPARING ALPHA-AMINO ACIDS PHILIPPS UNIV MARBURG (DE) 2024-11-13 EP disclosed
EP-4332089-A1 METHOD FOR PREPARING AMINO ACIDS PHILIPPS-UNIVERSITÄT MARBURG (DE) 2024-03-06 EP disclosed
CN-117285439-A Phenylalanine amide derivatives as beta 2 Use of allosteric antagonists of adrenergic receptors 常州大学 2023-12-26 CN disclosed
CN-116836081-A Ether epoxy toughening agent and preparation method and application thereof 中国林业科学研究院林产化学工业研究所 2023-10-03 CN disclosed
EP-4249470-A1 METHOD FOR PREPARING ALPHA-AMINO ACIDS PHILIPPS-UNIVERSITÄT MARBURG (DE) 2023-09-27 EP disclosed
EP-2800738-B1 HETEROCYCLIC COMPOUNDS AND METHODS FOR THEIR USE NOVARTIS AG (CH) 2020-04-08 EP disclosed
EP-3288527-B1 N-ARALKYLCARBONYLDIAMINE COMPOUNDS AND PERSONAL CARE COMPOSITIONS COMPRISING THE SAME UNILEVER PLC A COMPANY REGISTERED IN ENGLAND AND WALES UNDER COMPANY NO 41424 OF (GB) 2020-02-19 EP disclosed
CN-107011229-B The application method of heterocyclic compound and they 诺华股份有限公司 2019-11-05 CN disclosed
US-4454338-A 6-AMIDINO-2-NATHTHYL-4-GUANIDINOBENZOATE TORII & CO., LTD. (JP) 1984-06-12 US disclosed
EP-0048433-A2 Novel amidine compounds, process for producing same and anti-complement agent comprising them TORII & CO., LTD. (JP) 1982-03-31 EP disclosed
US-4247597-A Electroscopic carrier particles having a carboxylic acid surface treatment PITNEY BOWES, INC. (US) 1981-01-27 US disclosed
EP-0001503-B1 ANTITHROMBOTIC COMPOSITIONS CONTAINING BENZISOTHIAZOLONES BEECHAM GROUP PLC (GB) 1981-01-07 EP disclosed
EP-0001503-A1 Antithrombotic compositions containing benzisothiazolones BEECHAM GROUP PLC (GB) 1979-04-18 EP disclosed
US-4021478-A Preparation of carboxylic acids from glycidonitriles with ionic lewis acids THE UPJOHN COMPANY (US) 1977-05-03 US disclosed
US-3994964-A Processes for the production of carboxylic acids from glycidonitriles THE UPJOHN COMPANY (US) 1976-11-30 US disclosed
US-3975431-A Preparing carboxylic acids from glycidonitriles through enol acylates THE UPJOHN COMPANY (US) 1976-08-17 US disclosed