SCHEMBL7948980

SCHEMBL7948980

CCOC(=O)C(N)Cc1c(COc2ccc(Cl)cc2)n(C)c2ccccc12

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPY1R P25929 7/20 0.54
ELANE P08246 1/20 0.40
LMNA P02545 2/20 0.40
TP53 P04637 1/20 0.40
MAPT P10636 1/20 0.40
THRB P10828 1/20 0.40
BCL2 P10415 1/20 0.40
MCL1 Q07820 1/20 0.40
KDM4E B2RXH2 4/20 0.39
L3MBTL1 Q9Y468 3/20 0.39
ALOX15 P16050 1/20 0.39
TSHR P16473 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
ALDH1A1 P00352 3/20 0.38
GAA P10253 1/20 0.38
HPGD P15428 1/20 0.38
HSD17B10 Q99714 1/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 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
SCHEMBL7963655 0.82 NPY1R (0.60) NPY1RELANELMNAMAPTBCL2
SCHEMBL7959915 0.78 NPY1R (0.52) NPY1RELANELMNAMAPTBCL2
SCHEMBL7959920 0.78 NPY1R (0.52) NPY1RELANELMNAMAPTBCL2
SCHEMBL7948979 0.78 NPY1R (0.67) NPY1RLMNATP53KDM4EL3MBTL1
SCHEMBL7960734 0.77 NPY1R (0.65) NPY1RBCL2MCL1KDM4EL3MBTL1
SCHEMBL27479054 0.76 NPY1R (0.61) NPY1RBCL2MCL1KDM4EL3MBTL1
SCHEMBL7963645 0.76 NPY1R (0.70) NPY1RBCL2MCL1KDM4EL3MBTL1
SCHEMBL7959664 0.76 NPY1R (0.49) NPY1RELANELMNAMAPTBCL2
SCHEMBL7949130 0.76 NPY1R (0.49) NPY1RELANELMNABCL2MCL1
SCHEMBL7959662 0.76 NPY1R (0.49) NPY1RELANELMNAMAPTBCL2

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 6 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 claimed
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