SCHEMBL7948981

SCHEMBL7948981

CC(=O)NC1CCN(CC(O)c2c(COc3ccc(Cl)cc3)n(C)c3ccccc23)C1

nearest known ligand 0.51

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
NPY1R P25929 11/20 0.51
LTA4H P09960 3/20 0.47
ALDH1A1 P00352 1/20 0.43
MAPT P10636 1/20 0.43
SLC6A5 Q9Y345 1/20 0.41
CCR5 P51681 1/20 0.38
SSTR4 P31391 1/20 0.37

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
SCHEMBL7948983 0.84 NPY1R (0.49) NPY1RLTA4HALDH1A1MAPT
SCHEMBL7956848 0.83 NPY1R (0.53) NPY1RALDH1A1MAPT
SCHEMBL7963031 0.81 NPY1R (0.51) NPY1RALDH1A1MAPT
Hydrochloric Acid SCHEMBL7963649 0.81 NPY1R (0.69) NPY1RALDH1A1MAPT
SCHEMBL7959504 0.81 NPY1R (0.66) NPY1RALDH1A1MAPT
SCHEMBL7959215 0.80 NPY1R (0.60) NPY1RALDH1A1MAPT
SCHEMBL7960764 0.80 DRD4 (0.59) NPY1RALDH1A1MAPT
SCHEMBL7956729 0.76 NPY1R (0.48) NPY1RALDH1A1MAPT
SCHEMBL7960356 0.73 NPY1R (0.50) NPY1R
SCHEMBL7959128 0.72 NPY1R (0.71) 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