SCHEMBL5559581

SCHEMBL5559581

N#Cc1c(Cl)c2cc(Cl)cc(Cc3ccc(F)cc3)c2[nH]c1=O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 4/20 0.39
ALDH1A1 P00352 4/20 0.37
LMNA P02545 2/20 0.37
HPGD P15428 2/20 0.37
GFER P55789 2/20 0.37
KDM4E B2RXH2 5/20 0.37
MAPT P10636 2/20 0.37
GAA P10253 2/20 0.37
HTT P42858 2/20 0.37
KMT2A Q03164 2/20 0.37
HSD17B10 Q99714 1/20 0.37
IDO1 P14902 3/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
HCAR2 Q8TDS4 1/20 0.36
PDE3B Q13370 1/20 0.35
PDE3A Q14432 1/20 0.35
DAO P14920 1/20 0.34
MEN1 O00255 1/20 0.34
GLA P06280 1/20 0.34
CRHBP P24387 1/20 0.34

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
SCHEMBL359483 0.80 HSD11B1 (0.41) HSD11B1ALDH1A1LMNAHPGDGFER
SCHEMBL18584332 0.68 PTGES (0.49) HSD11B1ALDH1A1KDM4EMAPTGAA
SCHEMBL356250 0.68 KDM5A (0.49) ALDH1A1LMNAHPGDGFERKDM4E
SCHEMBL14916791 0.66 PDE9A (0.56) ALDH1A1LMNAHPGDKDM4EGAA
SCHEMBL5531607 0.65 KDM4E (0.53) ALDH1A1HPGDKDM4EMAPTHTT
SCHEMBL18796659 0.64 PDE3B (0.80) ALDH1A1LMNAHPGDKDM4EMAPT
SCHEMBL4851094 0.62 DAO (0.49) HSD11B1ALDH1A1LMNAHPGDKDM4E
SCHEMBL31483913 0.62 KDM4E (0.36) HSD11B1ALDH1A1LMNAHPGDKDM4E
SCHEMBL5528747 0.62 KDM4E (0.55) ALDH1A1HPGDKDM4EMAPTHTT
SCHEMBL4851891 0.61 DAO (0.44) KDM4EDAO

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1594501-A4 INHIBITORS OF MACROPHAGE MIGRATION INHIBITORY FACTOR AND METHODS FOR IDENTIFYING THE SAME AVANIR PHARMACEUTICALS (US) 2007-01-24 EP disclosed
EP-1594501-A2 INHIBITORS OF MACROPHAGE MIGRATION INHIBITORY FACTOR AND METHODS FOR IDENTIFYING THE SAME Avanir Pharmaceuticals (US) 2005-11-16 EP disclosed
WO-2004074218-A2 INHIBITORS OF MACROPHAGE MIGRATION INHIBITORY FACTOR AND METHODS FOR IDENTIFYING THE SAME AVANIR PHARMACEUTICALS (US) 2004-09-02 WO disclosed