SCHEMBL7963986

SCHEMBL7963986

NNC(=O)CCCN1CCC(c2ccc(F)cc2)CC1

nearest known ligand 0.62

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 5/20 0.62
MCHR1 Q99705 1/20 0.52
PRCP P42785 1/20 0.51
HTR1A P08908 4/20 0.50
DRD3 P35462 4/20 0.50
CCR2 P41597 4/20 0.50
HTR2A P28223 3/20 0.50
DRD1 P21728 2/20 0.50
DRD5 P21918 1/20 0.50
MEN1 O00255 1/20 0.50
CHRM2 P08172 1/20 0.50
ADRA2A P08913 1/20 0.50
ADRA1A P35348 1/20 0.50
OPRM1 P35372 1/20 0.50
KMT2A Q03164 1/20 0.50
KCNH2 Q12809 1/20 0.50
HRH3 Q9Y5N1 1/20 0.50
POLB P06746 1/20 0.46
HTT P42858 1/20 0.46

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
SCHEMBL7957652 0.87 DRD2 (0.55) DRD2MCHR1PRCPDRD3ADRA1A
SCHEMBL7961237 0.87 PRCP (0.52) DRD2MCHR1PRCPDRD3POLB
SCHEMBL7960163 0.87 DRD2 (0.62) DRD2MCHR1PRCPDRD3CCR2
SCHEMBL7949642 0.84 DRD2 (0.59) DRD2CCR2OPRM1KMT2APOLB
SCHEMBL7963815 0.83 DRD2 (0.50) DRD2MCHR1PRCPDRD3CCR2
SCHEMBL7964065 0.83 DRD2 (0.53) DRD2MCHR1PRCPDRD3CCR2
SCHEMBL7961377 0.81 DRD2 (0.58) DRD2PRCPHTR1AHTR2AKMT2A
SCHEMBL7963985 0.81 DRD2 (0.52) DRD2HTR1ADRD3CCR2HTR2A
SCHEMBL8001944 0.80 DRD2 (0.65) DRD2HTR1ADRD3CCR2HTR2A
SCHEMBL8011291 0.80 DRD2 (0.65) DRD2HTR1ADRD3CCR2HTR2A

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