SCHEMBL7008801

SCHEMBL7008801

Nc1ccc2c(c1)C1CCCN1CCC2

nearest known ligand 0.55

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CHRNA7 P36544 1/20 0.53
BRD4 O60885 1/20 0.43
ATAD2 Q6PL18 1/20 0.43

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
SCHEMBL7007153 0.94 CHRNA7 (0.61) CHRNA7
Hydrochloric Acid SCHEMBL7015509 0.92 CHRNA7 (0.59) CHRNA7
Iodide SCHEMBL8219528 0.92 CHRNA7 (0.59) CHRNA7
SCHEMBL7510798 0.89 CHRNA7 (0.55) CHRNA7
SCHEMBL6406991 0.86 MTNR1B (0.47) CHRNA7
SCHEMBL521174 0.84 CNR1 (0.48) CHRNA7BRD4ATAD2
SCHEMBL7010627 0.75 PDE7A (0.47) CHRNA7
Iodide SCHEMBL7847003 0.75 CHRNA7 (0.83) CHRNA7
SCHEMBL22993435 0.74 CHRNA7 (0.61) CHRNA7
SCHEMBL8219167 0.74 CHRNA7 (0.61) CHRNA7

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-1102769-B1 TRICYCLIC CARBOXAMIDES SMITHKLINE BEECHAM PLC (GB) 2003-04-16 EP disclosed