SCHEMBL7917299

SCHEMBL7917299

CCCNCCOc1ccccc1

nearest known ligand 0.74

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
DRD4 P21917 14/20 0.74
DRD2 P14416 13/20 0.74
DRD3 P35462 10/20 0.74
GAA P10253 1/20 0.65
HTR1B P28222 3/20 0.62
HTR1D P28221 1/20 0.62
HTR1A P08908 1/20 0.57
ADRA1D P25100 1/20 0.57
ADRA1A P35348 1/20 0.57
ADRA1B P35368 1/20 0.57
LTA4H P09960 1/20 0.55

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
SCHEMBL16606096 0.94 DRD2 (0.78) DRD4DRD2DRD3GAAHTR1B
SCHEMBL8938905 0.89 DRD4 (0.91) DRD4DRD2DRD3GAAHTR1B
SCHEMBL8825989 0.89 DRD2 (0.69) DRD4DRD2DRD3HTR1BHTR1D
SCHEMBL21453106 0.89 DRD2 (0.81) DRD4DRD2DRD3GAAHTR1B
SCHEMBL10339515 0.88 LTA4H (0.71) DRD4DRD2DRD3HTR1BLTA4H
SCHEMBL11895180 0.87 DRD2 (0.67) DRD4DRD2DRD3HTR1BHTR1D
SCHEMBL7991599 0.87 DRD2 (0.79) DRD4DRD2DRD3GAAHTR1B
SCHEMBL20072418 0.87 DRD4 (0.67) DRD4DRD2DRD3GAAHTR1B
SCHEMBL12177908 0.86 CYP1A2 (0.63) DRD4DRD2DRD3GAAHTR1B
SCHEMBL10974356 0.86 DRD4 (0.56) DRD4DRD2DRD3GAAHTR1B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9000107-B2 Process for producing polydienes BRIDGESTONE CORPORATION (JP) 2015-04-07 US claimed
EP-0403952-B1 An environmentally safe method of preparing a certain dialkylamine MAKHTESHIM CHEM WORKS LTD (IL) 1994-08-31 EP claimed
US-5093526-A ENVIRONMENTALLY SAFE METHOD OF PREPARING A CERTAIN DIALKYLAMINE MAKHTESHIM CHEMICAL WORKS LTD. (IL) 1992-03-03 US claimed
EP-0403952-A2 An environmentally safe method of preparing a certain dialkylamine MAKHTESHIM CHEMICAL WORKS LIMITED (IL) 1990-12-27 EP claimed
JP-2000744-A None JP disclosed
US-9000107-B2 Process for producing polydienes BRIDGESTONE CORPORATION (JP) 2015-04-07 US disclosed
US-6215001-B1 ANTIINFLAMMATORY AGENTS, ANTIASTHMATICS, AND ANTIALLERGENS; SIDE EFFECT REDUCTION KNOLL AKTIENGESELLSCHAFT (DE) 2001-04-10 US disclosed
US-5942544-A α-branched anilines, toluenes, and analogs thereof as factor Xa inhibitors DUPONT PHARMACEUTICALS COMPANY (US) 1999-08-24 US disclosed
EP-0403952-B1 An environmentally safe method of preparing a certain dialkylamine MAKHTESHIM CHEM WORKS LTD (IL) 1994-08-31 EP disclosed
EP-0321968-B1 COMPOUNDS ACTIVE ON THE CARDIOVASCULAR SYSTEM ZAMBON GROUP S.p.A. (IT) 1993-07-28 EP disclosed
US-5151414-A Hypotensive agents SIMES SOCIETA ITALIANA MEDICINALI E SINTETICI S.P.A. (IT) 1992-09-29 US disclosed
US-5093526-A ENVIRONMENTALLY SAFE METHOD OF PREPARING A CERTAIN DIALKYLAMINE MAKHTESHIM CHEMICAL WORKS LTD. (IL) 1992-03-03 US disclosed
US-5070106-A HYPOTENSIVES, CEREBRAL DISORDERS SIMES SOCIETA ITALIANA MEDICINALI E SINTETICI S.P.A. (IT) 1991-12-03 US disclosed
EP-0403952-A2 An environmentally safe method of preparing a certain dialkylamine MAKHTESHIM CHEMICAL WORKS LIMITED (IL) 1990-12-27 EP disclosed
EP-0403952-A2 An environmentally safe method of preparing a certain dialkylamine MAKHTESHIM CHEMICAL WORKS LIMITED (IL) 1990-12-27 EP disclosed
JP-H02744-A COMPOUNDS ACTIVE ON THE CARDIOVASCULAR SYSTEM SIMES SPA 1990-01-05 JP disclosed
EP-0321968-A2 Compounds active on the cardiovascular system ZAMBON GROUP S.p.A. (IT) 1989-06-28 EP disclosed
EP-0066987-A2 N-(aryloxyalkyl)-N'-(amino-alkyl) ureas A.H. ROBINS COMPANY, INCORPORATED (US) 1982-12-15 EP disclosed
US-4154945-A Fungicidal substituted imidazoles THE BOOTS COMPANY LIMITED (GB) 1979-05-15 US disclosed
US-4080462-A Fungicidal compositions containing substituted imidazoles THE BOOTS COMPANY LIMITED (EN) 1978-03-21 US disclosed