SCHEMBL6622147

SCHEMBL6622147

c1ccc2c(c1)CCC2CCN1CCN(c2cccc3ccccc23)CC1

nearest known ligand 0.65

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 3/20 0.50
HTR7 P34969 2/20 0.50
HTR2C P28335 1/20 0.49
DRD2 P14416 1/20 0.46
DRD3 P35462 1/20 0.46

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
SCHEMBL8344546 0.86 SIGMAR1 (0.53) HTR1AHTR7HTR2CDRD2DRD3
SCHEMBL1038535 0.79
SCHEMBL8343954 0.78 SIGMAR1 (0.58) HTR1AHTR7HTR2CDRD2DRD3
SCHEMBL9175625 0.77 HTR2C (0.44) HTR2C
SCHEMBL1038532 0.77 HTR2C (0.44) HTR2C
SCHEMBL8346145 0.77 HTR1A (0.43) HTR1AHTR7
SCHEMBL7405539 0.76 ALDH1A1 (0.53) HTR1ADRD2DRD3
SCHEMBL5655849 0.75 DRD3 (0.57) DRD2DRD3
Hydrochloric Acid SCHEMBL8185523 0.75 ALDH1A1 (0.52) HTR1ADRD2DRD3
SCHEMBL7401374 0.73 DRD2 (0.48) HTR1AHTR7DRD2DRD3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0976732-B1 1,4-SUBSTITUTED CYCLIC AMINE DERIVATIVES EISAI CO LTD (JP) 2004-11-24 EP disclosed
US-5929078-A ANTISEROTONINE AGENT SYNTHELABO (FR) 1999-07-27 US disclosed
US-5929078-A ANTISEROTONINE AGENT SYNTHELABO (FR) 1999-07-27 US disclosed
CN-1199398-A 1-[2-(2,3-dihydro-1H-inden-1-yl) ethyl]-4-(naphthalen-1-yl) piperazine derivs, preparation thereof and therapeutical use thereof SYNTHELABO (FR) 1998-11-18 CN disclosed
EP-0843670-A1 1-[2-(2,3-DIHYDRO-1H-INDEN-1-YL)ETHYL]-4-(NAPHTHALEN-1-YL)PIPERAZINE DERIVATIVES, PREPARATION THEREOF AND THERAPEUTICAL USE THEREOF SYNTHELABO (FR) 1998-05-27 EP disclosed
WO-1997006155-A1 1-[2-(2,3-DIHYDRO-1H-INDEN-1-YL)ETHYL]-4-(NAPHTHALEN-1-YL)PIPERAZINE DERIVATIVES, PREPARATION THEREOF AND THERAPEUTICAL USE THEREOF SYNTHELABO (FR) 1997-02-20 WO disclosed