SCHEMBL7958711

SCHEMBL7958711

CN(C)C1CCN(CCCc2c(COc3ccc(Cl)cc3)n(C)c3ccccc23)CC1

nearest known ligand 0.66

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
NPY1R P25929 18/20 0.66
HTR5A P47898 1/20 0.44
SIGMAR1 Q99720 1/20 0.43

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
SCHEMBL7956966 0.94 NPY1R (0.74) NPY1R
SCHEMBL7958847 0.89 NPY1R (0.74) NPY1RHTR5A
SCHEMBL7960758 0.84 NPY1R (0.57) NPY1R
SCHEMBL7960131 0.83 NPY1R (0.79) NPY1RSIGMAR1
SCHEMBL7959581 0.81 NPY1R (0.68) NPY1R
SCHEMBL7959923 0.80 NPY1R (1.00) NPY1RHTR5A
Hydrochloric Acid SCHEMBL7960370 0.80 NPY1R (0.69) NPY1R
SCHEMBL7963031 0.80 NPY1R (0.51) NPY1RHTR5A
SCHEMBL7956831 0.80 NPY1R (0.75) NPY1R
SCHEMBL7959225 0.79 NPY1R (1.00) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6245761-B1 NERVOUS SYSTEM, CARDIOVASCULAR AND RESPIRATORY SYSTEM DISORDERS ELI LILLY AND COMPANY 2001-06-12 US disclosed