SCHEMBL8724293

SCHEMBL8724293

S=C(Nc1ccc(-c2ccccc2)cc1)Nc1ccc2[nH]cc(C3CCC4CCCCN4CC3)c2c1

nearest known ligand 0.49

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 1/20 0.49
HTR1D P28221 13/20 0.47
HTR1B P28222 11/20 0.47
HTR1A P08908 2/20 0.47
HTR1F P30939 2/20 0.47
SLC6A4 P31645 3/20 0.45
RORC P51449 1/20 0.42
APP P05067 1/20 0.42

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
SCHEMBL8709412 0.88 SLC6A4 (0.52) HTR6HTR1DHTR1BHTR1AHTR1F
SCHEMBL8722115 0.86 SLC6A4 (0.50) HTR1DHTR1BHTR1AHTR1FSLC6A4
SCHEMBL8724294 0.85 HTR1D (0.46) HTR6HTR1DHTR1BHTR1AHTR1F
SCHEMBL8722085 0.85 HTR1A (0.51) HTR1DHTR1BHTR1AHTR1FSLC6A4
SCHEMBL8724022 0.84 HTR1D (0.48) HTR1DHTR1BHTR1AHTR1FSLC6A4
SCHEMBL30909306 0.83 HTR1D (0.50) HTR1DHTR1BHTR1AHTR1FSLC6A4
SCHEMBL8720715 0.83 HTR1D (0.43) HTR1DHTR1BHTR1AHTR1FSLC6A4
SCHEMBL8721182 0.82 SLC6A4 (0.48) HTR1DHTR1BHTR1AHTR1FSLC6A4
Fumaric Acid SCHEMBL8708476 0.82 HTR1D (0.46) HTR1DHTR1BHTR1AHTR1FSLC6A4
SCHEMBL8725963 0.82 HTR1D (0.44) HTR1DHTR1BHTR1AHTR1FSLC6A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0875513-A1 Substituted heteroaromatic 5-HT 1F agonists ELI LILLY AND COMPANY (US) 1998-11-04 EP disclosed