SCHEMBL7963665

SCHEMBL7963665

Cn1c(COc2ccc(Cl)cc2Cl)c(CCN2CCC(N3CCCCC3)CC2)c2ccccc21

nearest known ligand 0.77

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
NPY1R P25929 14/20 0.77
HRH3 Q9Y5N1 3/20 0.46
SMN1; SMN2 Q16637 2/20 0.43
F8 P00451 1/20 0.40
F5 P12259 1/20 0.40
TP53 P04637 1/20 0.40
MAPT P10636 1/20 0.40

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
SCHEMBL7958563 0.92 NPY1R (0.82) NPY1RHRH3SMN1; SMN2
SCHEMBL7959225 0.87 NPY1R (1.00) NPY1RHRH3
SCHEMBL7959581 0.86 NPY1R (0.68) NPY1R
Hydrochloric Acid SCHEMBL7957029 0.84 NPY1R (0.69) NPY1RHRH3
SCHEMBL7957272 0.83 NPY1R (0.70) NPY1RSMN1; SMN2F8F5TP53
Hydrochloric Acid SCHEMBL7959693 0.81 NPY1R (0.98) NPY1RSMN1; SMN2F8F5TP53
SCHEMBL7958870 0.80 NPY1R (0.86) NPY1RHRH3
SCHEMBL7963445 0.79 NPY1R (0.64) NPY1RSMN1; SMN2F8F5TP53
SCHEMBL7958627 0.79 NPY1R (1.00) NPY1RHRH3
SCHEMBL7959266 0.79 NPY1R (0.63) NPY1RSMN1; SMN2F8F5TP53

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 4 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
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