SCHEMBL7775193

SCHEMBL7775193

Oc1cc2c(cc1OCc1ccccc1)OCO2

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 8/20 0.59
KMT2A Q03164 1/20 0.48
TDP1 Q9NUW8 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
MAOA P21397 5/20 0.48
NPC1 O15118 2/20 0.46
RAB9A P51151 2/20 0.46
ALDH1A1 P00352 1/20 0.46
TP53 P04637 1/20 0.46
MAPT P10636 1/20 0.46
TSHR P16473 1/20 0.46
ATM Q13315 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
CALM1 P0DP23 2/20 0.44
HTR1A P08908 1/20 0.42
DRD2 P14416 1/20 0.42
LMNA P02545 1/20 0.42
CYP1A2 P05177 1/20 0.42
PTGS1 P23219 1/20 0.42
SLC6A2 P23975 1/20 0.42

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
SCHEMBL13854257 0.81 MAOB (0.59) MAOBKMT2ATDP1L3MBTL1MAOA
SCHEMBL9789581 0.81 MAOB (0.59) MAOBKMT2ATDP1L3MBTL1MAOA
SCHEMBL29198809 0.81 MAOB (0.59) MAOBKMT2ATDP1L3MBTL1MAOA
SCHEMBL11163647 0.81 LMNA (0.55) MAOBTDP1L3MBTL1MAPTHTR1A
SCHEMBL1316052 0.81 MAOB (0.58) MAOBKMT2ATDP1L3MBTL1MAOA
SCHEMBL21366597 0.80 MAOB (0.57) MAOBKMT2ATDP1L3MBTL1MAOA
SCHEMBL15787241 0.79 MAOB (0.54) MAOBTDP1L3MBTL1MAPTHTR1A
SCHEMBL14552343 0.79 MAOB (0.52) MAOBKMT2ATDP1L3MBTL1MAOA
SCHEMBL21363636 0.79 MAOB (0.59) MAOBKMT2ATDP1L3MBTL1MAOA
SCHEMBL10565899 0.79 MAOB (0.56) MAOBKMT2ATDP1L3MBTL1MAOA

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-0841334-B1 PROCESS FOR PRODUCING 1,4-BENZODIOXANE DERIVATIVES DAISO CO LTD (JP) 2001-10-04 EP disclosed
US-5780650-A Process for preparation of 1,4-benzodioxane derivative DAISO CO., LTD. (JP) 1998-07-14 US disclosed
EP-0841334-A1 PROCESS FOR PRODUCING 1,4-BENZODIOXANE DERIVATIVES DAISO CO., LTD. (JP) 1998-05-13 EP disclosed