SCHEMBL8917989

SCHEMBL8917989

Cc1cccc2scc(N3CCN(CCc4cc5c(s4)CCCC(=O)N5)CC3)c12

nearest known ligand 0.42

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 18/20 0.42
HTR1A P08908 17/20 0.42
HTR2A P28223 15/20 0.42
SLC6A4 P31645 2/20 0.39
HTR1D P28221 1/20 0.38
HTR1B P28222 1/20 0.38
KCNH2 Q12809 1/20 0.38

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
SCHEMBL8918317 0.90 HTR1A (0.46) DRD2HTR1AHTR2ASLC6A4
SCHEMBL8916474 0.86 HTR1A (0.41) DRD2HTR1AHTR2ASLC6A4HTR1D
SCHEMBL8918028 0.85 DRD2 (0.44) DRD2HTR1AHTR2ASLC6A4
SCHEMBL8917225 0.84 HTR1A (0.39) DRD2HTR1AHTR2ASLC6A4HTR1D
SCHEMBL8916905 0.83 MAPT (0.48) DRD2HTR1AHTR2ASLC6A4
SCHEMBL8916916 0.83 HTR2A (0.42) DRD2HTR1AHTR2A
SCHEMBL8917721 0.81 HTR1A (0.40) DRD2HTR1AHTR2ASLC6A4HTR1D
SCHEMBL8920388 0.80 MAPT (0.47) DRD2HTR1AHTR2A
SCHEMBL8916967 0.80 HTR2A (0.50) DRD2HTR1AHTR2A
SCHEMBL8919069 0.79 HTR1A (0.44) DRD2HTR1AHTR2ASLC6A4HTR1D

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
US-5691330-A ANTIPSYCHOTIC AGENT YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 1997-11-25 US disclosed