SCHEMBL16070002

SCHEMBL16070002

C=Cc1ccc2c(c1)CCC(N(C)C(=O)c1ccc(OCC3CC3)cn1)C2

nearest known ligand 0.58

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 20/20 0.58
HTR2C P28335 3/20 0.50
KCNH2 Q12809 3/20 0.50

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
SCHEMBL355258 1.00 MCHR1 (0.58) MCHR1HTR2CKCNH2
SCHEMBL355849 0.93 MCHR1 (0.60) MCHR1HTR2CKCNH2
SCHEMBL355850 0.93 MCHR1 (0.60) MCHR1HTR2CKCNH2
SCHEMBL355016 0.86 MCHR1 (0.61) MCHR1HTR2CKCNH2
SCHEMBL355017 0.86 MCHR1 (0.61) MCHR1HTR2CKCNH2
SCHEMBL419783 0.86 MCHR1 (0.68) MCHR1HTR2CKCNH2
SCHEMBL419782 0.86 MCHR1 (0.68) MCHR1HTR2CKCNH2
SCHEMBL10082972 0.81 MCHR1 (0.79) MCHR1HTR2CKCNH2
SCHEMBL354971 0.81 MCHR1 (0.60) MCHR1HTR2CKCNH2
SCHEMBL354970 0.81 MCHR1 (0.60) MCHR1HTR2CKCNH2

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
US-8841290-B2 Substituted tetrahydronaphthalenes, method for the production thereof, and use thereof as drugs SANOFI (FR) 2014-09-23 US disclosed