SCHEMBL7101452

SCHEMBL7101452

NC1CCc2ccc(NC=O)cc21

nearest known ligand 0.42

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ACHE P22303 10/20 0.42
MTNR1A P48039 1/20 0.35
OPRD1 P41143 1/20 0.34

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
SCHEMBL8521222 0.80 ADRA2A (0.46) MTNR1AOPRD1
Dimethylamine SCHEMBL8433452 0.78 OPRD1 (0.38) MTNR1AOPRD1
SCHEMBL7874968 0.75 MTNR1A (0.44) ACHEMTNR1A
SCHEMBL2463176 0.75 MTNR1A (0.60) ACHEMTNR1A
SCHEMBL25413828 0.75 ACHE (0.43) ACHEMTNR1A
SCHEMBL20283375 0.75 ACHE (0.44) ACHE
SCHEMBL8433448 0.74 MTNR1A (0.43) MTNR1AOPRD1
SCHEMBL7950364 0.74 MTNR1A (0.41) MTNR1A
SCHEMBL5969884 0.74 CA12 (0.48) ACHEMTNR1A
SCHEMBL8436852 0.73 MTNR1A (0.38) ACHEMTNR1AOPRD1

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-0923543-B1 POTASSIUM CHANNEL INHIBITORS ICAGEN INC (US) 2003-09-24 EP disclosed
US-6083986-A Potassium channel inhibitors ICAGEN, INC. (US) 2000-07-04 US disclosed
EP-0923543-A1 POTASSIUM CHANNEL INHIBITORS Icagen, Inc. (US) 1999-06-23 EP disclosed
WO-1998004521-A1 POTASSIUM CHANNEL INHIBITORS ICAGEN, INC. (US) 1998-02-05 WO disclosed