SCHEMBL8552856

SCHEMBL8552856

C=Cc1c(CCCC2CCN(CCCc3ccccc3)CC2)ccc2[nH]c(COc3ccc(Cl)cc3)nc12

nearest known ligand 0.52

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
NPY1R P25929 14/20 0.52
HRH3 Q9Y5N1 2/20 0.40
LTA4H P09960 1/20 0.39
BCHE P06276 1/20 0.39
MAOA P21397 1/20 0.39
ACHE P22303 1/20 0.39
MAOB P27338 1/20 0.39

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
SCHEMBL8555679 0.87 NPY1R (0.54) NPY1RHRH3LTA4H
SCHEMBL8553315 0.86 NPY1R (0.54) NPY1RHRH3
SCHEMBL8555754 0.85 NPY1R (0.52) NPY1RHRH3LTA4H
SCHEMBL8551322 0.85 NPY1R (0.57) NPY1R
SCHEMBL8551903 0.81 NPY1R (0.54) NPY1RBCHEMAOAACHEMAOB
SCHEMBL8552756 0.80 GPR119 (0.45) NPY1R
SCHEMBL7690344 0.80 NPY1R (0.47) NPY1RHRH3
SCHEMBL8555618 0.78 NPY1R (0.46) NPY1RBCHEACHE
SCHEMBL8551574 0.78 NPY1R (0.45) NPY1R
SCHEMBL8555811 0.77 NPY1R (0.49) NPY1R

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
EP-0871442-A1 BENZIMIDZOLYL NEUROPEPTIDE Y RECEPTOR ANTAGONISTS ELI LILLY AND COMPANY (US) 1998-10-21 EP disclosed
WO-1997025041-A1 BENZIMIDZOLYL NEUROPEPTIDE Y RECEPTOR ANTAGONISTS ELI LILLY AND COMPANY (US) 1997-07-17 WO disclosed