SCHEMBL7607969

SCHEMBL7607969

O=C1Cc2ccccc2N1CCN1CCCCC1

nearest known ligand 0.68

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
HTR7 P34969 17/20 0.68
DRD2 P14416 4/20 0.65
DRD4 P21917 1/20 0.65
HTR1A P08908 8/20 0.59
DRD5 P21918 3/20 0.59
DRD3 P35462 3/20 0.59
ALDH1A1 P00352 1/20 0.56
TP53 P04637 1/20 0.56

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
SCHEMBL3805479 0.90 HTR7 (0.72) HTR7DRD2HTR1ADRD5DRD3
SCHEMBL9044824 0.86 HTR7 (0.66) HTR7DRD2DRD4HTR1ADRD5
SCHEMBL31033189 0.86 DRD2 (0.64) HTR7DRD2DRD4DRD3ALDH1A1
SCHEMBL6923578 0.86 CA1 (0.55) HTR7DRD2DRD4HTR1ADRD5
SCHEMBL31033213 0.85 DRD2 (0.56) HTR7DRD2DRD4DRD3ALDH1A1
SCHEMBL2674982 0.84 DRD2 (0.66) HTR7DRD2DRD4DRD3
SCHEMBL9096389 0.82 DRD2 (0.83) HTR7DRD2DRD4HTR1ADRD5
SCHEMBL31033145 0.82 ALDH1A1 (0.51) HTR7DRD2DRD4HTR1ADRD5
SCHEMBL31033190 0.82 ALDH1A1 (0.51) HTR7DRD2DRD4HTR1ADRD5
SCHEMBL31033176 0.82 ALDH1A1 (0.51) HTR7DRD2DRD4HTR1ADRD5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0685463-B1 INDOLIN-2-ONE DERIVATIVE CHUGAI PHARMACEUTICAL CO LTD (JP) 2002-05-22 EP claimed