SCHEMBL5765086

SCHEMBL5765086

CCOC=Cc1ncccc1OC

nearest known ligand 0.51

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
NFE2L2 Q16236 11/20 0.51
PLAU P00749 1/20 0.37
SYK P43405 1/20 0.37
PDGFRB P09619 1/20 0.37
PDGFRA P16234 1/20 0.37
NPC1 O15118 2/20 0.36
RAB9A P51151 2/20 0.36
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
LMNA P02545 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
KDM4E B2RXH2 1/20 0.36
GAA P10253 1/20 0.36
MAPT P10636 1/20 0.36
MAPK1 P28482 1/20 0.36
GRM5 P41594 2/20 0.36
PDE10A Q9Y233 1/20 0.35
ALDH1A1 P00352 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
SCHEMBL28696174 0.79 TUBB1 (0.37) NFE2L2SYKMEN1KMT2ALMNA
SCHEMBL25806076 0.79 TUBB1 (0.37) NFE2L2SYKMEN1KMT2ALMNA
SCHEMBL8554208 0.79 NFE2L2 (0.51) NFE2L2PLAUSYKPDGFRBPDGFRA
SCHEMBL9000315 0.78 NFE2L2 (0.58) NFE2L2PLAUPDGFRBPDGFRANPC1
SCHEMBL14727114 0.75 FDPS (0.52) NFE2L2NPC1RAB9AMEN1KMT2A
SCHEMBL5641184 0.73 NFE2L2 (0.53) NFE2L2PLAUSYKPDGFRBPDGFRA
SCHEMBL33532515 0.72 NFE2L2 (0.52) NFE2L2PLAUPDGFRBPDGFRANPC1
SCHEMBL2084338 0.72 NFE2L2 (0.55) NFE2L2PLAUPDGFRBPDGFRANPC1
SCHEMBL4082035 0.72 NFE2L2 (0.51) NFE2L2PLAUPDGFRBPDGFRANPC1
SCHEMBL4378934 0.72 NFE2L2 (0.51) NFE2L2PLAUPDGFRBPDGFRANPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1658285-A1 COMPOUNDS, METHODS AND FORMULATIONS FOR THE ORAL DELIVERY OF A GLUCAGON LIKE PEPTIDE (GLP)-1 COMPOUND OR AN MELANOCORTIN 4 RECEPTOR (MC4) AGONIST PEPTIDE ELI LILLY AND COMPANY (US) 2006-05-24 EP disclosed
WO-2005019212-A1 COMPOUNDS, METHODS AND FORMULATIONS FOR THE ORAL DELIVERY OF A GLUCAGON LIKE PEPTIDE (GLP)-1 COMPOUND OR AN MELANOCORTIN 4 RECEPTOR (MC4) AGONIST PEPTIDE ELI LILLY AND COMPANY (US) 2005-03-03 WO disclosed