SCHEMBL7964141

SCHEMBL7964141

Clc1ccc(N2CCN(CCCc3[nH]nc4c3CSCC4)CC2)cc1

nearest known ligand 0.48

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 4/20 0.48
DRD3 P35462 12/20 0.45
DRD2 P14416 11/20 0.45
HTR1A P08908 9/20 0.45
HTR2A P28223 8/20 0.45
DRD1 P21728 7/20 0.45
HTR2C P28335 6/20 0.45
HTR7 P34969 5/20 0.45
SLC6A4 P31645 4/20 0.45
KDM4E B2RXH2 1/20 0.44
GAA P10253 1/20 0.44
TMEM97 Q5BJF2 3/20 0.43
DRD5 P21918 2/20 0.43
DRD4 P21917 2/20 0.43
HRH1 P35367 3/20 0.42

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
SCHEMBL5776753 0.89 MAPT (0.42) SIGMAR1DRD3DRD2HTR7SLC6A4
SCHEMBL5771928 0.89 DRD2 (0.43) SIGMAR1DRD3DRD2HTR1AHTR2A
SCHEMBL8563591 0.89 SIGMAR1 (0.49) SIGMAR1DRD3DRD2HTR1AHTR2A
SCHEMBL5772229 0.84 SIGMAR1 (0.52) SIGMAR1DRD3DRD2HTR1AHTR2A
Hydrochloric Acid SCHEMBL5770744 0.84 SIGMAR1 (0.51) SIGMAR1DRD3DRD2HTR1AHTR2A
SCHEMBL5776696 0.84 SIGMAR1 (0.51) SIGMAR1DRD3DRD2HTR1AHTR2A
SCHEMBL5775621 0.81 SIGMAR1 (0.48) SIGMAR1DRD3DRD2HTR1AHTR2A
SCHEMBL7959558 0.80 SIGMAR1 (0.47) SIGMAR1DRD3DRD2HTR1AHTR2A
SCHEMBL7957466 0.78 SIGMAR1 (0.58) SIGMAR1DRD3DRD2HTR1AHTR2A
SCHEMBL7964122 0.73 MAPT (0.45) SIGMAR1DRD3DRD2HTR7KDM4E

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