SCHEMBL8084103

SCHEMBL8084103

CN(C)CCCCCc1ccccc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 6/20 1.00
TAAR1 Q96RJ0 1/20 0.68
KCNH2 Q12809 2/20 0.59
AOC3 Q16853 1/20 0.59

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
SCHEMBL3132594 1.00 SIGMAR1 (1.00) SIGMAR1TAAR1KCNH2AOC3
SCHEMBL5721858 1.00 SIGMAR1 (1.00) SIGMAR1TAAR1KCNH2AOC3
SCHEMBL9151137 1.00 SIGMAR1 (1.00) SIGMAR1TAAR1KCNH2AOC3
SCHEMBL9670745 1.00 SIGMAR1 (1.00) SIGMAR1TAAR1KCNH2AOC3
SCHEMBL2117266 1.00 SIGMAR1 (1.00) SIGMAR1TAAR1KCNH2AOC3
SCHEMBL8498144 1.00 SIGMAR1 (1.00) SIGMAR1TAAR1KCNH2AOC3
SCHEMBL483816 1.00 SIGMAR1 (1.00) SIGMAR1TAAR1KCNH2AOC3
SCHEMBL10726207 1.00 SIGMAR1 (1.00) SIGMAR1TAAR1KCNH2AOC3
SCHEMBL8079373 1.00 SIGMAR1 (1.00) SIGMAR1TAAR1KCNH2AOC3
SCHEMBL22442307 1.00 SIGMAR1 (1.00) SIGMAR1TAAR1KCNH2AOC3

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
US-6057371-A TREATMENT OF CENTRAL NERVOUS SYSTEM DISORDERS, GASTROINTESTINAL DISORDERS, DRUG ABUSE, ANGINA, MIGRAINE, HYPERTENSION AND DEPRESSION VIRGINIA COMMONWEALTH UNIVERSITY (US) 2000-05-02 US claimed
EP-0591426-A1 SIGMA RECEPTOR LIGANDS AND THE USE THEREOF VIRGINIA COMMONWEALTH UNIVERSITY (US) 1994-04-13 EP claimed
WO-1993000313-A2 SIGMA RECEPTOR LIGANDS AND THE USE THEREOF VIRGINIA COMMONWEALTH UNIVERSITY (US) 1993-01-07 WO claimed
EP-0075524-B1 CARBONYLATION PROCESS OF CONJUGATED DIENES IN THE PRESENCE OF A PALLADIUM CATALYST WITH RECYCLING OF SAID CATALYST RHONE-POULENC CHIMIE DE BASE (FR) 1984-09-12 EP claimed
EP-0075524-A1 Carbonylation process of conjugated dienes in the presence of a palladium catalyst with recycling of said catalyst RHONE-POULENC CHIMIE DE BASE (FR) 1983-03-30 EP claimed
CN-117043136-A Fluorine-based ionic liquid and method for producing same 第一工业制药株式会社 2023-11-10 CN disclosed
WO-2022209538-A1 FLUORINE-BASED IONIC LIQUID AND PRODUCTION METHOD THEREOF 第一工業製薬株式会社 2022-10-06 WO disclosed
EP-3728237-B1 SUBSTITUTED THIOPHENYLURACILS , THEIR SALTS AND USE OF SAID COMPOUNDS AS HERBICIDAL AGENTS SYNGENTA CROP PROTECTION AG (CH) 2022-02-09 EP disclosed
EP-2589701-B1 METHOD FOR PRODUCING SIZING AGENT-COATED CARBON FIBERS, AND SIZING AGENT-COATED CARBON FIBERS TORAY INDUSTRIES (JP) 2019-08-21 EP disclosed
US-10184034-B2 Carbon fiber forming raw material, formed material, and carbon fiber-reinforced composite material TORAY INDUSTRIES, INC. (JP) 2019-01-22 US disclosed
EP-2765155-B1 CARBON FIBER-REINFORCED THERMOPLASTIC RESIN MOLDING MATERIAL AND METHODS FOR PRODUCING SAME TORAY INDUSTRIES (JP) 2018-03-14 EP disclosed
US-9771681-B2 Method for producing sizing agent-coated carbon fibers, and sizing agent-coated carbon fibers TORAY INDUSTRIES, INC. (JP) 2017-09-26 US disclosed
EP-2589701-A1 METHOD FOR PRODUCING SIZING AGENT-COATED CARBON FIBERS, AND SIZING AGENT-COATED CARBON FIBERS Toray Industries, Inc. (JP) 2013-05-08 EP disclosed
US-20130089736-A1 METHOD FOR PRODUCING SIZING AGENT-COATED CARBON FIBERS, AND SIZING AGENT-COATED CARBON FIBERS TORAY INDUSTRIES, INC. (JP) 2013-04-11 US disclosed
US-7514570-B2 Derivatives of 3-hydroxy-4-(cyclyl-alkylaminoalkyl)-5-phenyl-1h-pyrazole as antagonists of the gonadotropin releasing hormone (GnRH) for use in the treatment of sex hormone related conditions, such as prostatic of uterine cancer ASTRAZENECA AB (SE) 2009-04-07 US disclosed
US-6057371-A TREATMENT OF CENTRAL NERVOUS SYSTEM DISORDERS, GASTROINTESTINAL DISORDERS, DRUG ABUSE, ANGINA, MIGRAINE, HYPERTENSION AND DEPRESSION VIRGINIA COMMONWEALTH UNIVERSITY (US) 2000-05-02 US disclosed
EP-0591426-A1 SIGMA RECEPTOR LIGANDS AND THE USE THEREOF VIRGINIA COMMONWEALTH UNIVERSITY (US) 1994-04-13 EP disclosed
WO-1993000313-A2 SIGMA RECEPTOR LIGANDS AND THE USE THEREOF VIRGINIA COMMONWEALTH UNIVERSITY (US) 1993-01-07 WO disclosed
EP-0075524-B1 CARBONYLATION PROCESS OF CONJUGATED DIENES IN THE PRESENCE OF A PALLADIUM CATALYST WITH RECYCLING OF SAID CATALYST RHONE-POULENC CHIMIE DE BASE (FR) 1984-09-12 EP disclosed
EP-0075524-A1 Carbonylation process of conjugated dienes in the presence of a palladium catalyst with recycling of said catalyst RHONE-POULENC CHIMIE DE BASE (FR) 1983-03-30 EP disclosed