SCHEMBL7963264

SCHEMBL7963264

COC(=O)C(=O)c1c(COc2ccc(Cl)cc2)n(C)c2ccccc12

nearest known ligand 0.60

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
NPY1R P25929 7/20 0.60
MEN1 O00255 3/20 0.46
KMT2A Q03164 3/20 0.46
MAPT P10636 2/20 0.46
GAA P10253 2/20 0.46
NPC1 O15118 2/20 0.46
SMN1; SMN2 Q16637 2/20 0.45
KDM4E B2RXH2 3/20 0.43
TSHR P16473 2/20 0.43
TDP1 Q9NUW8 2/20 0.43
L3MBTL1 Q9Y468 2/20 0.43
ALOX15 P16050 1/20 0.43
ALDH1A1 P00352 2/20 0.42
HPGD P15428 1/20 0.42
NPSR1 Q6W5P4 1/20 0.40
HTR5A P47898 1/20 0.39

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
SCHEMBL7960792 0.89 NPY1R (0.58) NPY1RMEN1KMT2AMAPTGAA
SCHEMBL7949133 0.88 NPY1R (0.65) NPY1RMEN1KMT2AMAPTGAA
SCHEMBL7958788 0.88 NPY1R (0.62) NPY1RMEN1KMT2AMAPTGAA
SCHEMBL7956632 0.88 NPY1R (0.59) NPY1RMEN1KMT2AMAPTGAA
SCHEMBL7958879 0.87 NPY1R (0.61) NPY1RMEN1KMT2AMAPTGAA
SCHEMBL7958718 0.86 NPY1R (0.62) NPY1RMEN1KMT2AMAPTGAA
SCHEMBL7959706 0.83 NPY1R (0.55) NPY1RMEN1KMT2AMAPTGAA
SCHEMBL7956905 0.82 NPY1R (0.83) NPY1RMEN1KMT2AMAPTNPC1
SCHEMBL7963325 0.81 NPY1R (0.54) NPY1RMEN1KMT2AMAPTGAA
SCHEMBL7956916 0.81 NPY1R (0.57) NPY1RMEN1KMT2AMAPTGAA

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