SCHEMBL6159989

SCHEMBL6159989

c1ccc(Cc2ccccc2N2CCN(CC3(c4ccccc4)CC3)CC2)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 5/20 0.40
DRD3 P35462 4/20 0.40
DRD1 P21728 1/20 0.40
DRD5 P21918 1/20 0.40
ALDH1A1 P00352 2/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
DRD4 P21917 4/20 0.39
HTR7 P34969 1/20 0.39
KDM4E B2RXH2 1/20 0.38
PLA2G1B P04054 1/20 0.38
RAB9A P51151 1/20 0.38
ATG4B Q9Y4P1 1/20 0.38
HTR1A P08908 2/20 0.37
ADRA1D P25100 1/20 0.36
ADRA1A P35348 1/20 0.36
ADRA1B P35368 1/20 0.36
NR1H2 P55055 1/20 0.36
MAOA P21397 1/20 0.36
MAOB P27338 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
SCHEMBL8222205 0.91 MAPK1 (0.43) DRD2DRD3DRD1DRD5ALDH1A1
SCHEMBL6161129 0.75 HTR1A (0.52) DRD2DRD3ALDH1A1MEN1KMT2A
SCHEMBL27543706 0.74 ALDH1A1 (0.46) DRD2DRD3DRD1DRD5ALDH1A1
SCHEMBL2172785 0.74 HRH1 (0.47) DRD2DRD3DRD1DRD5MEN1
SCHEMBL8219466 0.74 GAA (0.47) DRD2DRD3DRD1DRD5ALDH1A1
Sifaprazine SCHEMBL21524898 0.73 NCF1 (0.58) DRD2DRD3DRD1DRD5ALDH1A1
SCHEMBL11488895 0.73 HRH1 (0.49) DRD2DRD3DRD1DRD5MEN1
SCHEMBL8828376 0.72 SIGMAR1 (0.59) DRD2DRD3DRD1DRD5ALDH1A1
Sifaprazine SCHEMBL9656921 0.72 NCF1 (0.56) DRD2DRD3ALDH1A1MEN1KMT2A
SCHEMBL19562130 0.71 SLC6A4 (0.52) DRD4HTR7ADRA1AMAOAMAOB

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0755923-B1 Ameliorant or remedy for symptoms caused by Ischemic diseases and Phenylpiperidine compounds useful therefor DAIICHI SUNTORY PHARMA CO LTD (JP) 2005-05-04 EP disclosed
US-6469010-B1 COMPOSITION ALSO FOR ALLEVIATION OR TREATMENT OF SYMPTOMS DERIVED FROM SEIZURES, EPILEPSY AND MIGRAINE HEADACHES, AND SUPPRESSION OF CALCIUM ION OVERLOAD SUNTORY LIMITED (JP) 2002-10-22 US disclosed
US-6048876-A ANTICONVULSANTS; ANTIEPILEPIC AGENT SUNTORY LIMITED (JP) 2000-04-11 US disclosed
EP-0755923-A1 AMELIORANT OR REMEDY FOR SYMPTOMS CAUSED BY ISCHEMIC DISEASES AND COMPOUNDS USEFUL THEREFOR SUNTORY LIMITED (JP) 1997-01-29 EP disclosed