SCHEMBL8802019

SCHEMBL8802019

Cn1c(COc2ccc(Cl)cc2)c(C(=O)C(=O)N2CCC(C(=O)CN)C2)c2ccccc21

nearest known ligand 0.71

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
NPY1R P25929 12/20 0.71
TP53 P04637 1/20 0.39
SMN1; SMN2 Q16637 2/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
KMT2A Q03164 2/20 0.38
ALDH1A1 P00352 3/20 0.35
HSD17B10 Q99714 1/20 0.35
HTR5A P47898 1/20 0.35
LMNA P02545 2/20 0.35
HTT P42858 1/20 0.35
MEN1 O00255 1/20 0.35
HPGD P15428 1/20 0.35

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
SCHEMBL7963219 0.88 NPY1R (0.75) NPY1RSMN1; SMN2L3MBTL1KMT2AALDH1A1
SCHEMBL7958736 0.86 NPY1R (0.71) NPY1RTP53SMN1; SMN2KMT2AALDH1A1
SCHEMBL7949187 0.85 NPY1R (0.79) NPY1RSMN1; SMN2KMT2AALDH1A1LMNA
SCHEMBL7956905 0.84 NPY1R (0.83) NPY1RKMT2AALDH1A1HTTMEN1
SCHEMBL7963164 0.83 NPY1R (1.00) NPY1RSMN1; SMN2KMT2A
SCHEMBL7956724 0.82 NPY1R (0.75) NPY1RTP53KMT2A
SCHEMBL7959104 0.81 NPY1R (0.73) NPY1RSMN1; SMN2L3MBTL1KMT2AMEN1
SCHEMBL7959050 0.81 NPY1R (0.87) NPY1RTP53SMN1; SMN2KMT2A
SCHEMBL7958925 0.80 NPY1R (0.71) NPY1RL3MBTL1KMT2AHTR5A
SCHEMBL7957137 0.79 NPY1R (0.69) NPY1RL3MBTL1KMT2AALDH1A1HTR5A

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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