SCHEMBL8533134

SCHEMBL8533134

COc1cc2c(cc1C)CCC(CCN1CCCC1)=C2

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 4/20 0.42
HTR2A P28223 2/20 0.41
KDM4E B2RXH2 2/20 0.38
HTR1A P08908 1/20 0.38
DRD2 P14416 1/20 0.38
HTR2C P28335 1/20 0.38
HTR7 P34969 1/20 0.38
HRH1 P35367 1/20 0.38
DRD3 P35462 1/20 0.38
HTR2B P41595 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.36
SMPD1 P17405 1/20 0.36
SIGMAR1 Q99720 2/20 0.36
RECQL P46063 1/20 0.36

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
SCHEMBL8535500 0.91 HRH3 (0.44) HRH3HTR2AHTR1ADRD2HTR2C
SCHEMBL8531818 0.86 HRH3 (0.45) HRH3HTR2AKDM4EHTR1ADRD2
Hydrochloric Acid SCHEMBL8535833 0.85 HRH3 (0.44) HRH3HTR2AKDM4EHTR1ADRD2
SCHEMBL8536585 0.85 HRH3 (0.44) HRH3HTR2AKDM4EHTR1ADRD2
SCHEMBL8535323 0.78 HRH3 (0.51) HRH3HTR2AHTR1ADRD2HTR2C
SCHEMBL8531883 0.77 MCHR1 (0.41) HRH3KDM4EHTR2CSMN1; SMN2
SCHEMBL8535845 0.77 HRH3 (0.39) HRH3HTR2AHTR1ADRD2HTR2C
Fumaric Acid SCHEMBL29737159 0.77 MCHR1 (0.38) HRH3HTR2AKDM4EHTR1ADRD2
SCHEMBL8531503 0.76 HTR2A (0.41) HRH3HTR2AHTR1ADRD2HTR2C
SCHEMBL8536618 0.75 HTR2C (0.43) HRH3HTR2AHTR1ADRD2HTR2C

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5847159-A 1- ω-(3,4-dihydro-2-naphthalenyl)alkyl!-cyclic amine derivatives, process for preparing the same, and pharmaceutical composition containing the same DAINIPPON PHARMACEUTICAL CO., LTD. (JP) 1998-12-08 US claimed
EP-0825180-A1 1-OMEGA-(3,4-DIHYDRO-2-NAPHTHALENYL)ALKYL] CYCLIC AMINE DERIVATIVES, PROCESS FOR PRODUCING THE SAME, AND MEDICINAL COMPOSITION CONTAINING THE SAME DAINIPPON PHARMACEUTICAL CO., LTD. (JP) 1998-02-25 EP claimed
US-5847159-A 1- ω-(3,4-dihydro-2-naphthalenyl)alkyl!-cyclic amine derivatives, process for preparing the same, and pharmaceutical composition containing the same DAINIPPON PHARMACEUTICAL CO., LTD. (JP) 1998-12-08 US disclosed
EP-0825180-A1 1-OMEGA-(3,4-DIHYDRO-2-NAPHTHALENYL)ALKYL] CYCLIC AMINE DERIVATIVES, PROCESS FOR PRODUCING THE SAME, AND MEDICINAL COMPOSITION CONTAINING THE SAME DAINIPPON PHARMACEUTICAL CO., LTD. (JP) 1998-02-25 EP disclosed