SCHEMBL8534629

SCHEMBL8534629

Fc1cc(F)c2c(c1)C=C(CCN1CCCC1)CC2

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SLC6A3 Q01959 4/20 0.40
MPO P05164 2/20 0.37
DRD2 P14416 3/20 0.35
SLC6A4 P31645 2/20 0.35
HTR2A P28223 3/20 0.35
HTR2C P28335 2/20 0.35
HTR1A P08908 1/20 0.35
HTR7 P34969 1/20 0.35
HRH1 P35367 1/20 0.35
DRD3 P35462 1/20 0.35
HTR2B P41595 1/20 0.35
KDM4E B2RXH2 2/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
HRH3 Q9Y5N1 2/20 0.33
SLC6A2 P23975 1/20 0.33
KCNH2 Q12809 1/20 0.33
SIGMAR1 Q99720 2/20 0.32

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
SCHEMBL8535301 0.80 DRD2 (0.44) SLC6A3DRD2SLC6A4HTR2AHTR2C
Hydrochloric Acid SCHEMBL8535321 0.79 DRD2 (0.43) SLC6A3DRD2SLC6A4HTR2AHTR2C
SCHEMBL8536618 0.77 HTR2C (0.43) SLC6A3MPODRD2SLC6A4HTR2A
SCHEMBL8531818 0.68 HRH3 (0.45) SLC6A3DRD2HTR2AHTR2CHTR1A
SCHEMBL14454756 0.67 HTR1A (0.71) SLC6A3DRD2HTR2AHTR2CHTR1A
SCHEMBL8536585 0.67 HRH3 (0.44) DRD2HTR2AHTR2CHTR1AHTR7
Hydrochloric Acid SCHEMBL8535833 0.67 HRH3 (0.44) SLC6A3DRD2HTR2AHTR2CHTR1A
SCHEMBL8583613 0.66 HTR1A (0.40) SLC6A3DRD2HTR2AHTR2CHTR1A
Hydrochloric Acid SCHEMBL8536660 0.66 HTR1A (0.69) SLC6A3DRD2HTR2AHTR2CHTR1A
SCHEMBL8531503 0.66 HTR2A (0.41) DRD2HTR2AHTR2CHTR1AHTR7

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