SCHEMBL16775014

SCHEMBL16775014

Cc1ccc2c(c1)c1c(n2CC(C)c2cccnc2)CC2CCC1N2C

nearest known ligand 0.39

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 6/20 0.39
HRH1 P35367 4/20 0.39
SIGMAR1 Q99720 2/20 0.33
MCHR1 Q99705 1/20 0.32

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
SCHEMBL6921046 0.89 HTR6 (0.40) HTR6HRH1SIGMAR1MCHR1
SCHEMBL6920818 0.85 HTR6 (0.40) HTR6HRH1MCHR1
SCHEMBL6921940 0.84 HTR6 (0.37) HTR6HRH1MCHR1
SCHEMBL13834003 0.84 HTR6 (0.39) HTR6HRH1
SCHEMBL15087610 0.83 HTR6 (0.36) HTR6HRH1
SCHEMBL13394766 0.83 HRH1 (0.56) HTR6HRH1SIGMAR1
SCHEMBL2814942 0.83 HTR6 (0.40) HTR6SIGMAR1MCHR1
SCHEMBL6922091 0.83 HTR6 (0.36) HTR6HRH1MCHR1
SCHEMBL6921358 0.81 HTR6 (0.40) HTR6HRH1SIGMAR1
SCHEMBL13833926 0.80 HTR6 (0.39) HTR6HRH1SIGMAR1MCHR1

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-9051314-B2 Bridged heterocyclic compounds and methods of use MEDIVATION TECHNOLOGIES, INC. (US) 2015-06-09 US disclosed
US-9051314-B2 Bridged heterocyclic compounds and methods of use MEDIVATION TECHNOLOGIES, INC. (US) 2015-06-09 US disclosed