SCHEMBL9063372

SCHEMBL9063372

CCN(CCCCCCN1C(=O)Cc2ccccc21)Cc1ccccc1

nearest known ligand 0.63

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MAOB P27338 4/20 0.63
BCHE P06276 3/20 0.63
ACHE P22303 3/20 0.63
HTR7 P34969 5/20 0.52
HTR1A P08908 3/20 0.50
DRD2 P14416 1/20 0.50
DRD5 P21918 1/20 0.50
DRD3 P35462 1/20 0.50

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
SCHEMBL9051174 1.00 MAOB (0.63) MAOBBCHEACHEHTR7HTR1A
SCHEMBL9048953 0.99 MAOB (0.62) MAOBBCHEACHEHTR7HTR1A
SCHEMBL9049638 0.87 MAOB (0.56) MAOBBCHEACHE
SCHEMBL9052662 0.87 ACHE (0.63) MAOBACHEHTR7HTR1ADRD2
SCHEMBL9049026 0.85 MAOB (0.54) MAOBBCHEACHE
SCHEMBL9048736 0.85 MAOB (0.54) MAOBBCHEACHE
SCHEMBL4500323 0.82 MAOB (0.51) MAOBBCHEACHEHTR7HTR1A
SCHEMBL9047059 0.81 MAOB (0.50) MAOBBCHEACHEHTR7HTR1A
SCHEMBL9056094 0.80 MAOB (0.48) MAOBBCHEACHE
SCHEMBL13945586 0.79 HTR7 (0.49) 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