SCHEMBL13622717

SCHEMBL13622717

O=c1cc(-c2ccc(Cl)cn2)ccn1-c1ccc2c(c1)CCN2C1CNC1

nearest known ligand 0.58

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 11/20 0.50
F10 P00742 1/20 0.38
SCD O00767 1/20 0.36
HTR2A P28223 1/20 0.36
HTR2C P28335 1/20 0.36
HTR2B P41595 1/20 0.36
DPP4 P27487 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 0.88 MCHR1 (0.49) MCHR1SCD
SCHEMBL13622724 0.86 MCHR1 (0.46) MCHR1F10HTR2AHTR2CHTR2B
SCHEMBL13622942 0.85 MCHR1 (0.46) MCHR1F10SCD
SCHEMBL13622680 0.85 MCHR1 (0.48) MCHR1SCD
SCHEMBL13623308 0.79 HTR2C (0.36) MCHR1HTR2AHTR2CHTR2B
SCHEMBL4455857 0.77 SLC6A2 (0.34) MCHR1HTR2CHTR2BDPP4
SCHEMBL13622867 0.75 MCHR1 (0.53) MCHR1
SCHEMBL13622868 0.75 MCHR1 (0.50) MCHR1
SCHEMBL4457815 0.73 MCHR1 (0.50) MCHR1SCDHTR2AHTR2C
SCHEMBL4444619 0.73 MCHR1 (0.43) MCHR1SCDHTR2CHTR2B

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