SCHEMBL3989929

SCHEMBL3989929

COC(=O)COc1ccc(Cl)c2ccc(Cl)nc12

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 6/20 0.52
KMT2A Q03164 2/20 0.52
PKM P14618 1/20 0.50
LMNA P02545 1/20 0.49
GAA P10253 2/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
TSHR P16473 1/20 0.41
HTT P42858 1/20 0.41
PTGDR Q13258 1/20 0.41
PTGDR2 Q9Y5Y4 1/20 0.41
CYP3A4 P08684 1/20 0.40
ALOX12 P18054 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
POLB P06746 1/20 0.40
ALDH1A1 P00352 1/20 0.39
HPGD P15428 1/20 0.39
MAPK1 P28482 1/20 0.39
MEN1 O00255 1/20 0.39
CYP1A2 P05177 1/20 0.39
MAPT P10636 1/20 0.39

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
SCHEMBL1153422 0.81 PKM (0.74) KDM4EKMT2APKMLMNAGAA
SCHEMBL29452815 0.81 PKM (0.74) KDM4EKMT2APKMLMNAGAA
SCHEMBL3981435 0.81 PKM (0.46) KDM4EKMT2APKMLMNASMN1; SMN2
SCHEMBL341900 0.77 LMNA (0.54) KDM4EKMT2APKMLMNAGAA
SCHEMBL5000233 0.76 LMNA (0.55) KDM4EKMT2APKMLMNAGAA
SCHEMBL28587779 0.75 KDM4E (0.51) KDM4EKMT2APKMLMNAGAA
SCHEMBL3987954 0.73 LMNA (0.52) KDM4EKMT2ALMNAGAASMN1; SMN2
SCHEMBL3989567 0.73 LMNA (0.41) KDM4EKMT2APKMLMNAGAA
SCHEMBL342560 0.72 KDM4E (0.47) KDM4EKMT2APKMLMNATSHR
SCHEMBL6643516 0.71 LMNA (0.43) KDM4EKMT2ALMNAGAASMN1; SMN2

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
WO-2009060209-A1 6,6-FUSED BICYCLIC AROMATIC COMPOUNDS AND THEIR THERAPEUTI USE ARGENTA DISCOVERY LIMITED (GB) 2009-05-14 WO disclosed