SCHEMBL7956835

SCHEMBL7956835

CC1CCN(Cc2c(COc3ccc(Cl)cc3)n(C)c3ccccc23)CC1

nearest known ligand 0.78

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
NPY1R P25929 9/20 0.78
SIGMAR1 Q99720 6/20 0.51
KDM4E B2RXH2 1/20 0.51
ALDH1A1 P00352 1/20 0.51
ALOX15 P16050 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.51
NPSR1 Q6W5P4 1/20 0.51
HSD17B10 Q99714 1/20 0.51
HRH3 Q9Y5N1 3/20 0.49

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
SCHEMBL7960131 0.91 NPY1R (0.79) NPY1RSIGMAR1HRH3
SCHEMBL7958847 0.89 NPY1R (0.74) NPY1R
SCHEMBL7963425 0.88 NPY1R (1.00) NPY1RALDH1A1HSD17B10HRH3
Hydrochloric Acid SCHEMBL7958491 0.88 NPY1R (0.96) NPY1RALDH1A1HSD17B10HRH3
SCHEMBL7960625 0.88 NPY1R (0.83) NPY1RKDM4EALDH1A1ALOX15SMN1; SMN2
SCHEMBL7959676 0.88 NPY1R (0.76) NPY1RHSD17B10HRH3
SCHEMBL7958627 0.87 NPY1R (1.00) NPY1RHRH3
Hydrochloric Acid SCHEMBL7956797 0.87 NPY1R (0.98) NPY1RALDH1A1HSD17B10HRH3
Hydrochloric Acid SCHEMBL7960187 0.86 NPY1R (0.80) NPY1RSIGMAR1KDM4EALDH1A1SMN1; SMN2
SCHEMBL7958759 0.85 NPY1R (0.86) NPY1RSIGMAR1SMN1; SMN2HRH3

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 5 patents. 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
CN-1173867-A Indolyl neuropeptide Y receptor antagonists LILLY CO ELI (US) 1998-02-18 CN disclosed
EP-0789688-A4 INDOLYL NEUROPEPTIDE Y RECEPTOR ANTAGONISTS LILLY CO ELI (US) 1997-11-19 EP disclosed
EP-0789688-A1 INDOLYL NEUROPEPTIDE Y RECEPTOR ANTAGONISTS ELI LILLY AND COMPANY (US) 1997-08-20 EP disclosed
WO-1997009308-A1 INDOLYL NEUROPEPTIDE Y RECEPTOR ANTAGONISTS ELI LILLY AND COMPANY (US) 1997-03-13 WO disclosed