SCHEMBL8291371

SCHEMBL8291371

Oc1noc2cc(OCc3ccccc3)ccc12

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 8/20 0.52
ACHE P22303 1/20 0.51
NPC1 O15118 3/20 0.50
MAOA P21397 3/20 0.50
TDP1 Q9NUW8 3/20 0.50
RAB9A P51151 2/20 0.50
LMNA P02545 1/20 0.50
CYP1A2 P05177 1/20 0.50
PTGS1 P23219 1/20 0.50
SLC6A2 P23975 1/20 0.50
CYP2C19 P33261 1/20 0.50
PTGS2 P35354 1/20 0.50
SLC6A3 Q01959 1/20 0.50
HIF1A Q16665 1/20 0.50
HDAC6 Q9UBN7 1/20 0.50
CASP3 P42574 1/20 0.50
SENP8 Q96LD8 1/20 0.50
SENP7 Q9BQF6 1/20 0.50
SENP6 Q9GZR1 1/20 0.50
MEN1 O00255 1/20 0.48

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
SCHEMBL8290792 0.89 MAOB (0.52) MAOBACHENPC1MAOATDP1
SCHEMBL8305850 0.83 MAOB (0.52) MAOBACHENPC1MAOATDP1
SCHEMBL4306909 0.82 MAOB (0.52) MAOBACHENPC1MAOATDP1
SCHEMBL17338654 0.80 CASP3 (0.54) MAOBACHENPC1MAOATDP1
SCHEMBL8304336 0.79 MAOB (0.51) MAOBACHENPC1MAOATDP1
SCHEMBL16576437 0.79 LTA4H (0.44) MAOBACHENPC1RAB9ACA1
SCHEMBL17338655 0.78 MAOB (0.48) MAOBACHENPC1MAOATDP1
SCHEMBL1324010 0.76 MAOB (0.56) MAOBACHENPC1MAOATDP1
SCHEMBL12636143 0.76 GSTP1 (0.47) LMNACYP1A2PTGS1SLC6A2CYP2C19
SCHEMBL1940939 0.76 MAOB (0.46) MAOBACHENPC1MAOATDP1

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
US-7166725-B2 Benzo[d]isoxazol-3-ol DAAO inhibitors SEPRACOR INC. (US) 2007-01-23 US disclosed
US-7166725-B2 Benzo[d]isoxazol-3-ol DAAO inhibitors SEPRACOR INC. (US) 2007-01-23 US disclosed
WO-2005066143-A2 BENZO[D]ISOXAZOL-3-OL DAAO INHIBITORS SEPRACOR INC. (US) 2005-07-21 WO disclosed