SCHEMBL7608635

SCHEMBL7608635

CC(C)CCOC(=O)CNC(=O)Oc1ncccc1O

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 1/20 0.45
GALR3 O60755 1/20 0.37
HSP90AA1 P07900 1/20 0.37
ALDH1A1 P00352 1/20 0.36
KMT2A Q03164 2/20 0.35
EPHX2 P34913 1/20 0.35
EGLN2 Q96KS0 1/20 0.35
FTO Q9C0B1 1/20 0.35
PPIA P62937 1/20 0.35
FAAH O00519 1/20 0.35
HPGD P15428 1/20 0.34
MEN1 O00255 1/20 0.34
MAPK1 P28482 2/20 0.34
CXCR1 P25024 1/20 0.34
CXCR2 P25025 1/20 0.34
KCNA5 P22460 1/20 0.34
PKM P14618 1/20 0.33
HSD17B10 Q99714 1/20 0.33
PSMB5 P28074 1/20 0.33
CHRM2 P08172 1/20 0.33

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
SCHEMBL7611608 0.87 FAAH (0.41) ALDH1A1KMT2AEGLN2FTOFAAH
SCHEMBL7606839 0.85 FAAH (0.47) KMT2AFAAHHPGDHSD17B10
SCHEMBL7607577 0.84 KDM4E (0.45) FAAHMAPK1
SCHEMBL7610436 0.83 EGLN2 (0.38) ALDH1A1KMT2AEGLN2FTOMEN1
SCHEMBL7614301 0.83 KDM4E (0.47) ALDH1A1FAAH
SCHEMBL7609545 0.83 KDM4E (0.47) ALDH1A1FAAH
SCHEMBL7605070 0.83 KDM4E (0.47) ALDH1A1FAAH
SCHEMBL7614162 0.83 KDM4E (0.47) ALDH1A1FAAH
SCHEMBL7605129 0.83 KDM4E (0.47) ALDH1A1FAAH
SCHEMBL7605083 0.83 KDM4E (0.47) ALDH1A1FAAH

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-0846685-B1 3-Hydroxypyridine-2-carboxylic acid amide esters, their preparation and their use as medicaments HOECHST AG (DE) 2002-03-13 EP disclosed
EP-0846685-A1 3-Hydroxypyridine-2-carboxylic acid amide esters, their preparation and their use as medicaments HOECHST AKTIENGESELLSCHAFT (DE) 1998-06-10 EP disclosed