SCHEMBL7957466

SCHEMBL7957466

Clc1ccc(N2CCN(CCCc3[nH]nc4c3CN(Cc3ccccc3)CC4)CC2)cc1

nearest known ligand 0.58

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 4/20 0.58
DRD4 P21917 4/20 0.52
HTR2C P28335 4/20 0.49
SLC6A4 P31645 2/20 0.47
SLC6A2 P23975 1/20 0.47
HTR7 P34969 3/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
DRD2 P14416 4/20 0.46
DRD3 P35462 4/20 0.46
HTR1A P08908 3/20 0.46
HTR2A P28223 2/20 0.46
TMEM97 Q5BJF2 1/20 0.46
CLPP Q16740 2/20 0.45
DRD1 P21728 3/20 0.45
CACNA1G O43497 1/20 0.44

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
SCHEMBL5774031 0.91 GAA (0.47) SIGMAR1DRD4HTR7L3MBTL1DRD2
SCHEMBL5772229 0.81 SIGMAR1 (0.52) SIGMAR1DRD4HTR2CSLC6A4HTR7
SCHEMBL5776696 0.80 SIGMAR1 (0.51) SIGMAR1DRD4HTR2CSLC6A4HTR7
Hydrochloric Acid SCHEMBL5770744 0.80 SIGMAR1 (0.51) SIGMAR1DRD4HTR2CSLC6A4HTR7
SCHEMBL7964141 0.78 SIGMAR1 (0.48) SIGMAR1DRD4HTR2CSLC6A4HTR7
SCHEMBL5775621 0.78 SIGMAR1 (0.48) SIGMAR1DRD4HTR2CSLC6A4SLC6A2
SCHEMBL5776684 0.77 SIGMAR1 (0.53) SIGMAR1DRD4HTR7DRD2DRD3
SCHEMBL5772832 0.77 SIGMAR1 (0.53) SIGMAR1DRD4HTR7DRD2DRD3
SCHEMBL5772457 0.76 SIGMAR1 (0.52) SIGMAR1DRD4HTR7DRD2DRD3
SCHEMBL9373810 0.76 SIGMAR1 (1.00) SIGMAR1DRD4HTR2CSLC6A4SLC6A2

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