SCHEMBL11775261

SCHEMBL11775261

c1ccc(CN2CC3CCC2CN3Cc2ccccc2)cc1

nearest known ligand 0.63

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 3/20 0.63

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
SCHEMBL9868061 0.92 SIGMAR1 (0.73) SIGMAR1
Hydrochloric Acid SCHEMBL9865080 0.90 SIGMAR1 (0.71) SIGMAR1
SCHEMBL29937379 0.85 SIGMAR1 (0.50) SIGMAR1
SCHEMBL10475095 0.83 CHRM2 (0.51) SIGMAR1
SCHEMBL6620817 0.82 SIGMAR1 (0.48) SIGMAR1
SCHEMBL6217467 0.81 SIGMAR1 (0.47) SIGMAR1
SCHEMBL10153638 0.80 SIGMAR1 (0.46) SIGMAR1
SCHEMBL2265216 0.80 SIGMAR1 (0.46) SIGMAR1
SCHEMBL10211436 0.79 SIGMAR1 (0.48) SIGMAR1
SCHEMBL20328234 0.79 SIGMAR1 (0.51) SIGMAR1

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-3951980-A 3-Substituted-8-methyl-3,8-diazabicyclo[3.2.1]octanes STANFORD RESEARCH INSTITUTE (US) 1976-04-20 US disclosed
US-3947445-A Diazabicyclooctanes and diazabicycloheptanes STANFORD RESEARCH INSTITUTE (US) 1976-03-30 US disclosed