SCHEMBL8551322

SCHEMBL8551322

Cc1c(CCCC2CCN(CCc3ccccc3)CC2)ccc2[nH]c(COc3ccc(Cl)cc3)nc12

nearest known ligand 0.57

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
NPY1R P25929 13/20 0.57
KCNH2 Q12809 1/20 0.42
DRD2 P14416 1/20 0.41
DRD4 P21917 1/20 0.41
DRD3 P35462 1/20 0.41
HTR1A P08908 1/20 0.41
SLC6A4 P31645 1/20 0.41

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
SCHEMBL8553315 0.95 NPY1R (0.54) NPY1R
SCHEMBL8551903 0.94 NPY1R (0.54) NPY1RDRD2DRD4
SCHEMBL8551574 0.88 NPY1R (0.45) NPY1RHTR1ASLC6A4
SCHEMBL8555678 0.88 NPY1R (0.45) NPY1R
SCHEMBL8555811 0.87 NPY1R (0.49) NPY1RHTR1ASLC6A4
SCHEMBL8555679 0.87 NPY1R (0.54) NPY1R
SCHEMBL8555618 0.86 NPY1R (0.46) NPY1RKCNH2DRD2DRD4DRD3
SCHEMBL8554433 0.86 NPY1R (0.47) NPY1R
SCHEMBL8555754 0.85 NPY1R (0.52) NPY1R
SCHEMBL8552856 0.85 NPY1R (0.52) 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