SCHEMBL8535323

SCHEMBL8535323

COc1ccc2c(c1)C=C(CCN1CCCC1)CC2

nearest known ligand 0.73

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 3/20 0.51
HTR2A P28223 3/20 0.45
SIGMAR1 Q99720 3/20 0.44
HTR1A P08908 1/20 0.44
DRD2 P14416 1/20 0.44
HTR2C P28335 1/20 0.44
HTR7 P34969 1/20 0.44
HRH1 P35367 1/20 0.44
DRD3 P35462 1/20 0.44
HTR2B P41595 1/20 0.44
SLC6A2 P23975 1/20 0.43
SLC6A4 P31645 1/20 0.43
SLC6A3 Q01959 1/20 0.43
MCHR1 Q99705 1/20 0.43

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 0.81 HRH3 (0.44) HRH3HTR2AHTR1ADRD2HTR2C
SCHEMBL8535840 0.79 ALDH1A1 (0.46) HTR2AHTR1ADRD2HTR2CHTR7
SCHEMBL8533789 0.79 CYP11B2 (0.45) DRD2DRD3
SCHEMBL8533134 0.78 HRH3 (0.42) HRH3HTR2ASIGMAR1HTR1ADRD2
SCHEMBL8532823 0.77 HTR1A (0.45) HRH3HTR2ASIGMAR1HTR1ADRD2
SCHEMBL8531818 0.76 HRH3 (0.45) HRH3HTR2ASIGMAR1HTR1ADRD2
SCHEMBL14454756 0.76 HTR1A (0.71) HRH3HTR2ASIGMAR1HTR1ADRD2
SCHEMBL5904263 0.76 MCHR1 (0.63) SIGMAR1HTR2CMCHR1
SCHEMBL8531779 0.75 HTR2C (0.43) HTR2AHTR1ADRD2HTR2CHTR7
SCHEMBL8536585 0.75 HRH3 (0.44) HRH3HTR2ASIGMAR1HTR1ADRD2

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 2 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 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