SCHEMBL7933844

SCHEMBL7933844

COc1cc(O)c2c(=O)c3ccc(OC)c(OC)c3oc2c1

nearest known ligand 0.72

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAOA P21397 6/20 0.72
MGAM O43451 5/20 0.69
ACHE P22303 1/20 0.67
MAOB P27338 1/20 0.67
ABCG2 Q9UNQ0 4/20 0.61
ABCB1 P08183 2/20 0.61
ABCC1 P33527 2/20 0.61
KDM4E B2RXH2 1/20 0.60
ALDH1A1 P00352 1/20 0.60
LMNA P02545 1/20 0.60
MAPT P10636 1/20 0.60
HPGD P15428 1/20 0.60
GAA P10253 1/20 0.56
SI P14410 1/20 0.56
MGAM2 Q2M2H8 1/20 0.56
ESR1 P03372 1/20 0.56
ESR2 Q92731 1/20 0.56

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
SCHEMBL28334427 0.91 MGAM (0.70) MAOAMGAMACHEMAOBABCB1
SCHEMBL4785647 0.90 MAOA (0.70) MAOAMGAMACHEMAOBABCG2
SCHEMBL15918251 0.86 MAOA (0.66) MAOAMGAMACHEMAOBABCG2
SCHEMBL27734348 0.85 MAOA (0.65) MAOAMGAMACHEMAOBABCG2
SCHEMBL30786761 0.85 MAOA (0.65) MAOAMGAMACHEMAOBABCG2
SCHEMBL7931361 0.84 MAOA (1.00) MAOAMGAMACHEMAOBKDM4E
Decussatin SCHEMBL30061117 0.83 MAOA (1.00) MAOAMGAMABCG2ABCB1ABCC1
Decussatin SCHEMBL15918485 0.83 MAOA (1.00) MAOAMGAMABCG2ABCB1ABCC1
Decussatin SCHEMBL31093409 0.83 MAOA (1.00) MAOAMGAMABCG2ABCB1ABCC1
SCHEMBL27979675 0.82 MGAM (1.00) MAOAMGAMACHEMAOBABCG2

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-6224906-B1 STABLE, FREE-FLOWING POWDER NATREON INC. 2001-05-01 US disclosed