SCHEMBL10697621

SCHEMBL10697621

COc1ccc(-c2nc(N)c[nH]2)cc1OC

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 6/20 0.59
HSD17B10 Q99714 1/20 0.59
ALDH1A1 P00352 4/20 0.53
GAA P10253 1/20 0.53
MPI P34949 1/20 0.53
GFER P55789 1/20 0.53
APOBEC3G Q9HC16 1/20 0.53
TDP1 Q9NUW8 1/20 0.53
KIT P10721 5/20 0.47
ALOX5 P09917 1/20 0.47
EPHX2 P34913 1/20 0.47
DYRK1A Q13627 1/20 0.46
PDGFRB P09619 1/20 0.45
PDGFRA P16234 1/20 0.45
HPGD P15428 2/20 0.45
MEN1 O00255 2/20 0.45
KMT2A Q03164 2/20 0.45
LMNA P02545 1/20 0.45
POLB P06746 1/20 0.45
MAPT P10636 1/20 0.45

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
SCHEMBL30387478 0.83 KDM4E (0.55) KDM4EHSD17B10ALDH1A1GAAMPI
SCHEMBL26093677 0.83 KDM4E (0.55) KDM4EHSD17B10ALDH1A1GAAMPI
SCHEMBL6599439 0.78 KDM4E (0.56) KDM4EALDH1A1GAAMPIGFER
SCHEMBL11780539 0.77 HPGD (0.52) KDM4EHSD17B10ALDH1A1GAAMPI
SCHEMBL15330739 0.77 KDM4E (0.49) KDM4EHSD17B10ALDH1A1GAAMPI
SCHEMBL29008478 0.76 KDM4E (0.48) KDM4EHSD17B10ALDH1A1GAAMPI
SCHEMBL1660430 0.75 KDM4E (0.60) KDM4EHSD17B10ALDH1A1KITPDGFRB
SCHEMBL7708794 0.74 KDM4E (0.54) KDM4EHSD17B10ALDH1A1GAAMPI
SCHEMBL14381414 0.73 ALDH1A1 (0.51) KDM4EHSD17B10ALDH1A1GAAMPI
SCHEMBL7370877 0.73 MEN1 (0.48) KDM4EHSD17B10ALDH1A1GAAMPI

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-0253084-A2 1,3-Disubstituted imidazolium salts F. HOFFMANN-LA ROCHE AG (CH) 1988-01-20 EP disclosed