SCHEMBL8831005

SCHEMBL8831005

CCN(CCOc1ccc(NC(=O)c2cccc3c(=O)c4ccccc4oc23)cc1)CCc1ccc(OC)c(OC)c1

nearest known ligand 0.49

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 3/20 0.49
▸ KDR P35968 2/20 0.48
▸ MAOB P27338 1/20 0.44
▸ ADORA2B P29275 1/20 0.44
▸ ACHE P22303 4/20 0.43
▸ BCHE P06276 1/20 0.43
▸ MCHR1 Q99705 2/20 0.43
▸ XDH P47989 1/20 0.43
▸ MEN1 O00255 1/20 0.43
▸ KMT2A Q03164 1/20 0.43
▸ ABCB1 P08183 1/20 0.42
▸ TP53 P04637 2/20 0.42
▸ RXFP1 Q9HBX9 1/20 0.42
▸ HDAC1 Q13547 1/20 0.41
▸ HDAC8 Q9BY41 1/20 0.41
▸ HDAC6 Q9UBN7 1/20 0.41

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
SCHEMBL8808718 0.91 MAPT (0.48) MAPTKDRMAOBADORA2BACHE
SCHEMBL8808344 0.89 ACHE (0.49) MAPTKDRMAOBADORA2BACHE
SCHEMBL8815521 0.87 ACHE (0.52) MAPTKDRACHEBCHE
SCHEMBL8815533 0.84 KDR (0.48) MAPTKDRMAOBADORA2BACHE
SCHEMBL8807556 0.82 MAOB (0.47) MAPTMAOBADORA2BMEN1KMT2A
SCHEMBL8831013 0.82 MAPT (0.48) MAPTMAOBADORA2BMCHR1MEN1
SCHEMBL8808731 0.81 MAPT (0.48) MAPTMAOBADORA2BMCHR1MEN1
SCHEMBL8808353 0.81 MAPT (0.47) MAPTMAOBADORA2BMCHR1MEN1
SCHEMBL8815541 0.78 MAOB (0.46) MAPTKDRMAOBADORA2BMCHR1
SCHEMBL8830578 0.75 MAOB (0.45) MAPTMAOBADORA2BMEN1KMT2A

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
US-5663179-A CAN SENSITIZE MULTIDRUG RESISTANT CANCER CELLS TO CHEMOTHERAPEUTIC AGENTS LABORATOIRES GLAXO SA (FR) 1997-09-02 — — US disclosed
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