SCHEMBL9049355

SCHEMBL9049355

O=C1Cc2ccccc2N1CCCCCBr

nearest known ligand 0.63

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
HTR7 P34969 18/20 0.63
HTR1A P08908 9/20 0.63
DRD2 P14416 3/20 0.59
DRD5 P21918 3/20 0.59
DRD3 P35462 3/20 0.59

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
Oxindole SCHEMBL9054033 0.88 HTR7 (0.52) HTR7HTR1ADRD2DRD5DRD3
SCHEMBL29612136 0.87 HTR7 (0.57) HTR7HTR1ADRD2DRD5DRD3
SCHEMBL1232169 0.87 HTR7 (0.57) HTR7HTR1ADRD2DRD5DRD3
SCHEMBL285431 0.87 HTR2A (0.50) HTR7HTR1ADRD2DRD5DRD3
SCHEMBL5384961 0.86 DRD2 (0.59) DRD2DRD3
SCHEMBL23339326 0.84 HTR7 (0.63) HTR7HTR1ADRD2DRD5DRD3
SCHEMBL15396975 0.84 HTR7 (0.63) HTR7HTR1ADRD2DRD5DRD3
SCHEMBL30641128 0.84 HTR7 (0.63) HTR7HTR1ADRD2DRD5DRD3
SCHEMBL1764224 0.84 DRD2 (0.60) DRD2DRD3
SCHEMBL19691138 0.83 HTR7 (0.62) HTR7HTR1ADRD2DRD5DRD3

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
EP-0703901-A1 1-SUBSTITUTED ISATIN AND OXINDOLE DERIVATIVES AS INHIBITORS OF ACETYLCHOLINESTERASE Astra Aktiebolag (SE) 1996-04-03 EP disclosed
WO-1994029272-A1 1-SUBSTITUTED ISATIN AND OXINDOLE DERIVATIVES AS INHIBITORS OF ACETYLCHOLINESTERASE ASTRA AKTIEBOLAG (SE) 1994-12-22 WO disclosed