SCHEMBL22239386

SCHEMBL22239386

N#Cc1ncc(-c2cccc(Cl)c2)cc1O

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.51
EGLN1 Q9GZT9 4/20 0.48
VEGFA P15692 3/20 0.48
FLT1 P17948 3/20 0.48
EGLN3 Q9H6Z9 3/20 0.48
TET3 O43151 1/20 0.48
BBOX1 O75936 1/20 0.48
ASPH Q12797 1/20 0.48
TET2 Q6N021 1/20 0.48
KDM8 Q8N371 1/20 0.48
OGFOD1 Q8N543 1/20 0.48
TET1 Q8NFU7 1/20 0.48
HIF1AN Q9NWT6 1/20 0.48
ESR2 Q92731 1/20 0.44
FYN P06241 1/20 0.43
ALOX15 P16050 1/20 0.43
MAP4K4 O95819 2/20 0.43
ADORA2A P29274 3/20 0.42
ADORA1 P30542 3/20 0.42
ADORA2B P29275 2/20 0.42

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
SCHEMBL15153839 0.85 ALOX5 (0.51) ALOX5EGLN1VEGFAFLT1EGLN3
SCHEMBL14122956 0.84 ALOX15 (0.45) ALOX15MAP4K4ADORA2AADORA1ADORA2B
SCHEMBL30957058 0.84 ALOX15 (0.45) ALOX15MAP4K4ADORA2AADORA1ADORA2B
SCHEMBL24011999 0.82 PIK3CD (0.59) FYNALOX15MAP4K4ADORA2AADORA1
SCHEMBL22239389 0.82 ESR2 (0.47) ESR2ALOX15MAP4K4ADORA2AADORA1
SCHEMBL23501739 0.79 ALOX5 (0.59) ALOX5EGLN1VEGFAFLT1EGLN3
SCHEMBL22326630 0.78 KDM4E (0.41) EGLN1VEGFAFLT1EGLN3TET3
SCHEMBL20248019 0.78 ALOX15 (0.43) EGLN1VEGFAFLT1EGLN3TET3
SCHEMBL31104706 0.78 FYN (0.52) EGLN1VEGFAFLT1EGLN3FYN
SCHEMBL14122536 0.78 FYN (0.52) EGLN1VEGFAFLT1EGLN3FYN

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3683209-A1 PROCESS FOR PREPARING [(5-(3-CHLOROPHENYL)-3-HYDROXYPYRIDINE-2-CARBONYL)-AMINO]ACETIC ACID FROM 5-((3-CHLOROPHENYL)-3-CHLORO-PYRIDIN-2-YL)-NITRILE, AND PROCESS FOR PREPARING 5-((HALOPHENYL)-3-HALO-PYRIDIN-2-YL)-NITRILE DERIVATIVES Akebia Therapeutics Inc. (US) 2020-07-22 EP disclosed