SCHEMBL13315554

SCHEMBL13315554

CN(CCCN1CCC2(CC1)OCc1cc(F)ncc12)C(=O)C(c1ccc(F)c(F)c1)N1CCCC1=O

nearest known ligand 0.80

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 20/20 0.80
ADRA1A P35348 7/20 0.80
KCNH2 Q12809 4/20 0.53

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
SCHEMBL13315557 0.94 MCHR1 (0.80) MCHR1ADRA1AKCNH2
SCHEMBL13315553 0.91 MCHR1 (0.82) MCHR1ADRA1AKCNH2
SCHEMBL13315551 0.90 MCHR1 (0.85) MCHR1ADRA1AKCNH2
SCHEMBL13315550 0.89 MCHR1 (0.86) MCHR1ADRA1A
SCHEMBL13315511 0.89 MCHR1 (1.00) MCHR1ADRA1A
SCHEMBL13315578 0.88 MCHR1 (0.82) MCHR1ADRA1AKCNH2
SCHEMBL13315529 0.87 MCHR1 (0.96) MCHR1ADRA1A
SCHEMBL13315548 0.86 MCHR1 (0.84) MCHR1ADRA1A
SCHEMBL13315564 0.86 MCHR1 (0.79) MCHR1ADRA1AKCNH2
SCHEMBL13315552 0.85 MCHR1 (0.82) MCHR1ADRA1A

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-7727998-B2 Melanin-concentrating hormone receptor antagonists containing piperidine derivatives as the active ingredient BANYU PHARMACEUTICAL CO., LTD. (JP) 2010-06-01 US disclosed
US-7727998-B2 Melanin-concentrating hormone receptor antagonists containing piperidine derivatives as the active ingredient BANYU PHARMACEUTICAL CO., LTD. (JP) 2010-06-01 US disclosed