SCHEMBL8580305

SCHEMBL8580305

CCOC(=O)C1=COc2cccc(OC)c2O1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.47
KDM4E B2RXH2 3/20 0.47
MEN1 O00255 3/20 0.47
KMT2A Q03164 3/20 0.47
NPC1 O15118 1/20 0.47
RAB9A P51151 1/20 0.47
LMNA P02545 3/20 0.40
HSD17B2 P37059 1/20 0.40
CA12 O43570 1/20 0.40
CA1 P00915 1/20 0.40
CA2 P00918 1/20 0.40
CA7 P43166 1/20 0.40
CA9 Q16790 1/20 0.40
CA14 Q9ULX7 1/20 0.40
GAA P10253 1/20 0.39
ALOX5 P09917 1/20 0.39
CDC25B P30305 1/20 0.39
HTT P42858 1/20 0.39
HPGD P15428 1/20 0.39
CYP1A2 P05177 2/20 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
SCHEMBL8580415 0.89 MAPT (0.47) MAPTKDM4EMEN1KMT2ANPC1
SCHEMBL7823936 0.83 CA12 (0.46) MAPTKDM4EMEN1KMT2ACA12
SCHEMBL7201067 0.78 TSHR (0.50) MAPTKDM4EMEN1KMT2ALMNA
SCHEMBL8580296 0.72 MAOB (0.49) MAPTKDM4EMEN1KMT2ANPC1
SCHEMBL7819889 0.71 CA12 (0.46) MAPTKDM4EMEN1KMT2ACA12
SCHEMBL10455857 0.71 CA12 (0.63) MAPTKDM4EMEN1KMT2ALMNA
SCHEMBL5337504 0.70 PTGS2 (0.47) MAPTKDM4EMEN1KMT2ANPC1
Biphenyl SCHEMBL1394409 0.68 TSHR (0.53) MAPTKDM4EMEN1KMT2ANPC1
SCHEMBL30786817 0.68
SCHEMBL28840933 0.68

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-5807882-A ANTITUMOR AGENTS ADIR ET COMPAGNIE (FR) 1998-09-15 US disclosed