SCHEMBL5804458

SCHEMBL5804458

C=CCN1CCCC1CN

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 9/20 0.38
DRD3 P35462 7/20 0.36
DRD4 P21917 6/20 0.36
HTR1A P08908 3/20 0.35
CA12 O43570 1/20 0.35
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
ADRA2A P08913 1/20 0.35
ADRA2B P18089 1/20 0.35
ADRA2C P18825 1/20 0.35
DRD1 P21728 1/20 0.35
CA4 P22748 1/20 0.35
CA6 P23280 1/20 0.35
HTR2A P28223 1/20 0.35
SLC6A4 P31645 1/20 0.35
CA5A P35218 1/20 0.35
CA7 P43166 1/20 0.35
KCNH2 Q12809 1/20 0.35
CA9 Q16790 1/20 0.35
CA13 Q8N1Q1 1/20 0.35

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
SCHEMBL9154751 1.00 DRD2 (0.38) DRD2DRD3DRD4HTR1ACA12
SCHEMBL8649163 0.94 DRD2 (0.34) DRD2DRD3DRD4HTR1ACA12
Isothiocyanate SCHEMBL11011138 0.90 DRD2 (0.34) DRD2DRD3DRD4HTR1ACA12
SCHEMBL7372904 0.85 DRD2 (0.36) DRD2DRD3DRD4HTR1ACA12
SCHEMBL8799867 0.82 CHRNB2 (0.37) DRD2DRD3DRD4HTR1ACA12
SCHEMBL8436147 0.80 POLB (0.42) DRD2DRD3DRD4HTR1ACA12
SCHEMBL11445454 0.80 DRD2 (0.36) DRD2DRD3DRD4HTR1ACA12
SCHEMBL11300057 0.80 POLB (0.42) DRD2DRD3DRD4HTR1ACA12
SCHEMBL11251940 0.80 DRD2 (0.36) DRD2DRD3DRD4HTR1ACA12
SCHEMBL9036814 0.79

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-5155847-A None JP claimed
CN-118374897-A Multifunctional composite flame-retardant fiber and preparation method thereof 邦特云纤(青岛)新材料科技有限公司 2024-07-23 CN claimed
CN-117510958-A Method for manufacturing super-hydrophobic PMMA material and super-hydrophobic PMMA material 浙江华帅特新材料科技有限公司 2024-02-06 CN claimed
CN-109142498-B Preparation method of paraquat molecular imprinting sensor 济南大学 2020-09-04 CN claimed
CN-109001285-B Preparation method of prometryn molecular imprinting sensor 济南大学 2020-06-23 CN claimed
CN-109142498-A A kind of preparation method of paraquat molecular engram sensor 济南大学 2019-01-04 CN claimed
CN-109001285-A A kind of preparation method of prometryn molecular engram sensor 济南大学 2018-12-14 CN claimed
EP-0539281-A1 New naphthamides, process for their preparation and their application in the therapeutical field INSTITUT NATIONAL DE LA SANTE ET DE LA RECHERCHE MEDICALE (INSERM) (FR) 1993-04-28 EP claimed
EP-0047207-B1 N-(1-ALLYL-2-PYRROLIDINYL-METHYL)-2-METHOXY-4-AMINO-5-METHYL-SULFAMOYL BENZAMIDE, PROCESS FOR ITS PREPARATION AND ITS USE AS A MEDICINE SOCIETE D'ETUDES SCIENTIFIQUES ET INDUSTRIELLES DE L'ILE-DE-FRANCE (FR) 1985-02-20 EP claimed
JP-5155847-A None JP disclosed
JP-5331135-A None JP disclosed
JP-56095165-A None JP disclosed
CN-119708596-A Anti-reflection PMMA optical material and manufacturing method thereof 浙江华帅特新材料科技有限公司 2025-03-28 CN disclosed
CN-118374897-A Multifunctional composite flame-retardant fiber and preparation method thereof 邦特云纤(青岛)新材料科技有限公司 2024-07-23 CN disclosed
JP-S5695165-A PREPARATION OF SUBSTITUTED BENZOIC ACID AMIDE SATO YOSHIO 1981-08-01 JP disclosed
US-4268512-A ANXIOLYTIC AGENTS, PSYCHOSTIMULANTS SOCIETE D'ETUDES SCIENTIFIQUES ET INDUSTRIELLES DE L'ILE-DE-FRANCE (FR) 1981-05-19 US disclosed
US-4255580-A TREATMENT OF PSYCHOLOGICAL DISORDERS SIOCIETE D'ETUDES SCIENTIFIQUES ET INDUSTRIELLES DE L'ILE-DE-FRANCE (FR) 1981-03-10 US disclosed
US-4248885-A FOR GASTROINTESTINAL, UROGENITAL, RHEUMATIC, AND CARDIOVASCULAR DISEASE SOCIETE D'ETUDES SCIENTIFIQUES ET INDUSTRIELLES DE L'ILE-DE-FRANCE (FR) 1981-02-03 US disclosed
US-4186135-A TREATMENT OF PSYCHOLOGICAL DISORDERS SOCIETE D'ETUDES SCIENTIFIQUES ET INDUSTRIELLES DE L'ILE-DE-FRANCE (FR) 1980-01-29 US disclosed
US-4039672-A EMESIS SOCIETE D'ETUDES SCIENTIFIQUES ET INDUSTRIELLES DE L'ILE-DE-FRANCE (FR) 1977-08-02 US disclosed