SCHEMBL7220415

SCHEMBL7220415

Fc1ccc2[nH]cc(CC3CCN(CCOc4ccc5c(c4)CCC5)CC3)c2c1

nearest known ligand 0.59

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 2/20 0.59
SLC6A4 P31645 2/20 0.50
SLC6A2 P23975 1/20 0.50
SLC6A3 Q01959 1/20 0.50
HTR1D P28221 1/20 0.49
HTR1B P28222 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
SCHEMBL7213780 0.78 HTR1A (0.69) HTR1ASLC6A4
SCHEMBL7082302 0.77 HTR1A (0.70) HTR1ASLC6A4
SCHEMBL13499597 0.76 SLC6A4 (0.69) HTR1ASLC6A4
SCHEMBL28718866 0.76 HTR1A (0.75) HTR1ASLC6A4
SCHEMBL29534340 0.75 HTR1A (0.62) HTR1ASLC6A4
SCHEMBL28707500 0.75 HTR1A (0.62) HTR1ASLC6A4
Hydrochloric Acid SCHEMBL8171208 0.75 LTA4H (0.55) SLC6A4SLC6A2SLC6A3
SCHEMBL28715827 0.75 HTR1A (0.61) HTR1ASLC6A4
SCHEMBL29534330 0.75 HTR1A (0.61) HTR1ASLC6A4
SCHEMBL29535418 0.74 HTR1A (0.59) HTR1ASLC6A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6610712-B2 Treating serotonin-related central nervous system disorders WYETH 2003-08-26 US claimed
WO-2002048105-A2 ARYLOXY PIPERIDINYL DERIVATIVES FOR THE TREATMENT OF DEPRESSION WYETH (US) 2002-06-20 WO claimed
US-6610712-B2 Treating serotonin-related central nervous system disorders WYETH 2003-08-26 US disclosed
WO-2002048105-A2 ARYLOXY PIPERIDINYL DERIVATIVES FOR THE TREATMENT OF DEPRESSION WYETH (US) 2002-06-20 WO disclosed