SCHEMBL7958905

SCHEMBL7958905

CN(C)C1CCN(C(=O)C(=O)c2c(COc3ccc(Cl)cc3Cl)n(C)c3ccccc23)CC1

nearest known ligand 0.60

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
NPY1R P25929 13/20 0.60
KMT2A Q03164 3/20 0.40
HPGD P15428 2/20 0.40
USP2 O75604 1/20 0.40
XBP1 P17861 1/20 0.39
SIGMAR1 Q99720 1/20 0.38
MEN1 O00255 1/20 0.38
ALDH1A1 P00352 1/20 0.38

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
SCHEMBL7956724 0.89 NPY1R (0.75) NPY1RKMT2A
SCHEMBL7957231 0.85 NPY1R (0.51) NPY1RKMT2AHPGDUSP2XBP1
SCHEMBL7957048 0.80 NPY1R (0.76) NPY1R
SCHEMBL7959581 0.80 NPY1R (0.68) NPY1R
SCHEMBL7949187 0.78 NPY1R (0.79) NPY1RKMT2AHPGDSIGMAR1MEN1
SCHEMBL7963219 0.78 NPY1R (0.75) NPY1RKMT2AMEN1ALDH1A1
SCHEMBL7956905 0.75 NPY1R (0.83) NPY1RKMT2AHPGDMEN1ALDH1A1
SCHEMBL7963164 0.75 NPY1R (1.00) NPY1RKMT2A
SCHEMBL7959104 0.75 NPY1R (0.73) NPY1RKMT2AMEN1
SCHEMBL7956831 0.74 NPY1R (0.75) NPY1RKMT2AMEN1

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