SCHEMBL13622942

SCHEMBL13622942

CC(C)N1CC(N2CCc3cc(-n4ccc(-c5ccc(Cl)cn5)cc4=O)ccc32)C1

nearest known ligand 0.61

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 11/20 0.46
F10 P00742 2/20 0.41
KCNH2 Q12809 1/20 0.41
SCD O00767 1/20 0.36
GRIA2 P42262 1/20 0.35

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
SCHEMBL13622679 0.90 MCHR1 (0.49) MCHR1SCD
SCHEMBL13622680 0.88 MCHR1 (0.48) MCHR1SCD
SCHEMBL13622717 0.85 MCHR1 (0.50) MCHR1F10SCD
SCHEMBL4444373 0.78 MCHR1 (0.41) MCHR1F10
SCHEMBL13622867 0.78 MCHR1 (0.53) MCHR1
SCHEMBL4457815 0.77 MCHR1 (0.50) MCHR1SCD
SCHEMBL13622868 0.75 MCHR1 (0.50) MCHR1
SCHEMBL4444619 0.74 MCHR1 (0.43) MCHR1SCD
SCHEMBL13622939 0.72 MCHR1 (0.45) MCHR1F10
SCHEMBL13622724 0.71 MCHR1 (0.46) MCHR1F10

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
WO-2009137270-A2 AZETIDINE DERIVATIVES H. LUNDBECK A/S (DK) 2009-11-12 WO disclosed