SCHEMBL8920388

SCHEMBL8920388

O=C1CCCc2sc(CCN3CCN(c4csc5ccc(F)cc45)CC3)cc2N1

nearest known ligand 0.47

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.47
HTR2A P28223 14/20 0.44
HTR1A P08908 12/20 0.44
DRD2 P14416 12/20 0.44
DRD4 P21917 2/20 0.42
TP53 P04637 3/20 0.42
LMNA P02545 1/20 0.42
THRB P10828 1/20 0.39

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
SCHEMBL8916967 0.93 HTR2A (0.50) MAPTHTR2AHTR1ADRD2DRD4
SCHEMBL8916905 0.90 MAPT (0.48) MAPTHTR2AHTR1ADRD2TP53
SCHEMBL8916916 0.84 HTR2A (0.42) MAPTHTR2AHTR1ADRD2DRD4
SCHEMBL8916899 0.84 HTR1A (0.41) HTR2AHTR1ADRD2
SCHEMBL8919069 0.83 HTR1A (0.44) HTR2AHTR1ADRD2
SCHEMBL8918317 0.83 HTR1A (0.46) HTR2AHTR1ADRD2
SCHEMBL8919178 0.82 HTR1A (0.41) HTR2AHTR1ADRD2DRD4
SCHEMBL8917989 0.80 DRD2 (0.42) HTR2AHTR1ADRD2
SCHEMBL8916474 0.80 HTR1A (0.41) HTR2AHTR1ADRD2
SCHEMBL8918049 0.79 DRD2 (0.42) HTR2AHTR1ADRD2DRD4

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 2 patents. 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
US-5532240-A ANTIPSYCHOTIC AGENTS AND ANTISEROTONIN AGENTS YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 1996-07-02 US disclosed