SCHEMBL7437193

SCHEMBL7437193

CCCN(CC1CCC1)C1CCc2c(ccc3[nH]ccc23)C1

nearest known ligand 0.78

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
HTR1D P28221 16/20 0.78
HTR1B P28222 12/20 0.68
HTR1A P08908 2/20 0.49
DRD2 P14416 1/20 0.49

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
SCHEMBL7434651 0.90 HTR1D (0.83) HTR1DHTR1BDRD2
SCHEMBL8316283 0.88 HTR1D (1.00) HTR1DHTR1BHTR1ADRD2
SCHEMBL8315482 0.81 HTR1D (1.00) HTR1DHTR1B
SCHEMBL7447504 0.81 HTR1D (0.84) HTR1DHTR1BDRD2
SCHEMBL7441015 0.81 HTR1D (0.69) HTR1DHTR1BHTR1ADRD2
SCHEMBL7436234 0.81 HTR1D (0.86) HTR1DHTR1BDRD2
SCHEMBL7442744 0.78 HTR1D (0.81) HTR1DHTR1B
SCHEMBL7439303 0.77 HTR1D (0.87) HTR1DHTR1BHTR1ADRD2
SCHEMBL8315256 0.75 HTR1D (1.00) HTR1DHTR1B
SCHEMBL8316440 0.74 HTR1D (1.00) HTR1DHTR1BDRD2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5639778-A TREATING CENTRAL NERVOUS SYSTEM DISORDERS PHARMACIA & UPJOHN COMPANY (US) 1997-06-17 US disclosed
EP-0690843-A1 INDOLETETRALINS HAVING DOPAMINERGIC ACTIVITY PHARMACIA & UPJOHN COMPANY (US) 1996-01-10 EP disclosed
WO-1994021608-A1 INDOLETETRALINS HAVING DOPAMINERGIC ACTIVITY THE UPJOHN COMPANY (US) 1994-09-29 WO disclosed