SCHEMBL8916475

SCHEMBL8916475

O=C1NCCCc2cc(CCN3CCC(c4coc5cc(F)ccc45)CC3)sc21

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 6/20 0.40
HTR2C P28335 2/20 0.38
SLC6A4 P31645 2/20 0.37
ACHE P22303 3/20 0.37
HTR2A P28223 4/20 0.36
DRD3 P35462 2/20 0.36
ADRA1D P25100 3/20 0.36
HTR1A P08908 2/20 0.36
SLC22A2 O15244 1/20 0.36
CACNA1F O60840 1/20 0.36
ADRB2 P07550 1/20 0.36
CHRM2 P08172 1/20 0.36
CHRM4 P08173 1/20 0.36
CHRM5 P08912 1/20 0.36
ADRA2A P08913 1/20 0.36
CYP2D6 P10635 1/20 0.36
CHRM1 P11229 1/20 0.36
TSHR P16473 1/20 0.36
ADRA2B P18089 1/20 0.36
ADRA2C P18825 1/20 0.36

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
SCHEMBL8919063 0.91 DRD2 (0.40) DRD2SLC6A4HTR2ADRD3HTR1A
SCHEMBL8916470 0.85 DRD2 (0.37) DRD2HTR2CSLC6A4ACHEHTR2A
SCHEMBL8916845 0.85 DRD2 (0.39) DRD2SLC6A4HTR2ADRD3HTR1A
SCHEMBL8919173 0.84 ACHE (0.58) DRD2HTR2CSLC6A4ACHEHTR2A
SCHEMBL8918733 0.83 DRD2 (0.38) DRD2HTR2CSLC6A4ACHEHTR2A
SCHEMBL8916891 0.80 DRD2 (0.38) DRD2HTR2CSLC6A4ACHEHTR2A
Hydrochloric Acid SCHEMBL8916112 0.79 DRD2 (0.37) DRD2HTR2CSLC6A4ACHEHTR2A
SCHEMBL8915782 0.77 DRD2 (0.38) DRD2HTR2CSLC6A4ACHEHTR2A
SCHEMBL9782691 0.72 ACHE (0.43) DRD2SLC6A4ACHEHTR2ADRD3
SCHEMBL8916437 0.71 DRD2 (0.59) DRD2HTR2CSLC6A4ACHEHTR2A

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