SCHEMBL10679019

SCHEMBL10679019

O=C1Cc2cc(N3CCN(Cc4ccccc4)CC3)ccc2N1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 9/20 0.59
DRD4 P21917 8/20 0.59
DRD3 P35462 6/20 0.59
GAA P10253 4/20 0.54
MEN1 O00255 1/20 0.50
KMT2A Q03164 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
HTR1A P08908 4/20 0.48
HTR2A P28223 2/20 0.48
ADRA1B P35368 2/20 0.48
ADRA1D P25100 1/20 0.48
ADRA1A P35348 1/20 0.48
CHRM5 P08912 1/20 0.48
ADRA2A P08913 1/20 0.48
ADRA2B P18089 1/20 0.48
TMEM97 Q5BJF2 1/20 0.48
SIGMAR1 Q99720 1/20 0.48
CRBN Q96SW2 1/20 0.48
SLC6A2 P23975 1/20 0.48
SLC6A4 P31645 1/20 0.48

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
SCHEMBL9096425 0.79 GAA (0.55) GAAMEN1KMT2ASMN1; SMN2
SCHEMBL17006463 0.79 ALDH1A1 (0.48) DRD2DRD4DRD3HTR1AHTR2A
SCHEMBL9824652 0.78 MEN1 (0.63) MEN1KMT2ASMN1; SMN2SIGMAR1
SCHEMBL9825127 0.78 GRIN2B (0.66) DRD2DRD4DRD3KMT2AHTR1A
SCHEMBL9098720 0.78 GAA (0.57) GAAMEN1KMT2ASMN1; SMN2
SCHEMBL9412262 0.78 DRD4 (0.60) DRD2DRD4DRD3GAASMN1; SMN2
SCHEMBL11194558 0.77 DRD4 (0.59) DRD2DRD4DRD3GAAHTR1A
SCHEMBL11196367 0.77 SLC6A4 (0.52) DRD2DRD4DRD3GAAHTR1A
SCHEMBL9824743 0.76 MAPKAPK2 (0.53) GAAMEN1KMT2ASMN1; SMN2
Hydrochloric Acid SCHEMBL10682276 0.76 GRIN2B (0.64) DRD2DRD4DRD3KMT2AHTR1A

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
US-4737501-A Substituted piperazinyl oxindol compounds and cardiotonic compositions containing the same OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1988-04-12 US claimed
EP-0168003-A1 Oxindol compounds, compositions containing same and processes for preparing same OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1986-01-15 EP claimed
US-4737501-A Substituted piperazinyl oxindol compounds and cardiotonic compositions containing the same OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1988-04-12 US disclosed
EP-0168003-A1 Oxindol compounds, compositions containing same and processes for preparing same OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1986-01-15 EP disclosed