SCHEMBL7959539

SCHEMBL7959539

Fc1cc(Cl)ccc1C1CCN(CCCc2onc3c2CCCCC3)CC1

nearest known ligand 0.45

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
OPRL1 P41146 3/20 0.37
ADRA1D P25100 2/20 0.36
MCHR1 Q99705 1/20 0.35
HTR1A P08908 2/20 0.35
DRD2 P14416 2/20 0.35
HTR2A P28223 2/20 0.35
HRH3 Q9Y5N1 2/20 0.35
HTR2C P28335 1/20 0.35
ADRA1A P35348 1/20 0.35
HRH1 P35367 1/20 0.35
DRD3 P35462 1/20 0.35
HTR6 P50406 1/20 0.35
KCNH2 Q12809 1/20 0.35
ACHE P22303 1/20 0.34

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
SCHEMBL7963612 0.90 DRD4 (0.38) MCHR1DRD2DRD3
SCHEMBL7964115 0.85 MCHR1 (0.38) MCHR1HTR1ADRD2HTR2ADRD3
SCHEMBL7960253 0.85 DRD2 (0.43) MCHR1DRD2HRH3DRD3
SCHEMBL7963820 0.84 DRD2 (0.47) MCHR1HTR1ADRD2HTR2ADRD3
SCHEMBL7963834 0.83 DRD2 (0.48) MCHR1HTR1ADRD2HTR2ADRD3
SCHEMBL7960891 0.83 MCHR1 (0.36) MCHR1HTR1ADRD2HTR2AHRH3
SCHEMBL7964142 0.83 DRD2 (0.43) OPRL1ADRA1DHTR1ADRD2HTR2A
SCHEMBL7959597 0.82 HTR1A (0.41) OPRL1ADRA1DHTR1ADRD3KCNH2
SCHEMBL7959473 0.81 MAPT (0.35) ADRA1DHTR1ADRD2HTR2AHTR6
SCHEMBL8571313 0.79 DRD2 (0.50) ADRA1DDRD2HRH3HRH1

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-6187774-B1 N-PIPERAZINYLALKYLINDAZOLE DERIVATIVES; PSYCHOLOGICAL DISORDERS, SCHIZOPHRENIA; SIDE EFFECT REDUCTION YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 2001-02-13 US disclosed
EP-0885883-A1 FUSED HETEROCYCLIC COMPOUNDS AND PHARMACEUTICAL APPLICATIONS THEREOF YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 1998-12-23 EP disclosed