SCHEMBL8208580

SCHEMBL8208580

CN1CCC[C@@H]1Cc1cn(C(=O)c2ccccc2)c2ccccc12

nearest known ligand 0.62

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 19/20 0.62
CHRNB2 P17787 1/20 0.49
CHRNA5 P30532 1/20 0.49
CHRNA7 P36544 1/20 0.49
CHRNA4 P43681 1/20 0.49

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
SCHEMBL8208586 1.00 HTR6 (0.62) HTR6CHRNB2CHRNA5CHRNA7CHRNA4
SCHEMBL8213326 0.91 HTR6 (0.56) HTR6
SCHEMBL8200923 0.91 HTR6 (0.56) HTR6
SCHEMBL8213128 0.90 HTR6 (0.64) HTR6
SCHEMBL8208554 0.90 HTR6 (0.64) HTR6
SCHEMBL6967984 0.87 HTR6 (0.49) HTR6CHRNB2CHRNA5CHRNA7CHRNA4
SCHEMBL6965704 0.87 HTR6 (0.49) HTR6CHRNB2CHRNA5CHRNA7CHRNA4
SCHEMBL6965707 0.87 HTR6 (0.49) HTR6CHRNB2CHRNA5CHRNA7CHRNA4
SCHEMBL8209782 0.87 HTR6 (0.64) HTR6CHRNB2CHRNA5CHRNA7CHRNA4
SCHEMBL8209785 0.87 HTR6 (0.64) HTR6CHRNB2CHRNA5CHRNA7CHRNA4

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
US-6100291-A FOR TREATMENT OF CENTRAL NERVOUS SYSTEM DISORDERS ALLELIX BIOPHARMACEUTICALS INC. (CA) 2000-08-08 US disclosed
WO-1999047516-A1 3-(2-PYRROLIDINYLMETHYL)-INDOLE COMPOUNDS HAVING 5-HT6 AFFINITY SLASSI ABDELMALIK (CA) 1999-09-23 WO disclosed