SCHEMBL28459079

SCHEMBL28459079

O=C(/C=C/c1ccccc1F)c1cc2ccccc2oc1=O

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 9/20 0.73
MGAM O43451 1/20 0.61
GAA P10253 1/20 0.61
SI P14410 1/20 0.61
MGAM2 Q2M2H8 1/20 0.61
MAOA P21397 3/20 0.55
RAB9A P51151 4/20 0.54
NPC1 O15118 3/20 0.54
ALDH1A1 P00352 3/20 0.54
LMNA P02545 2/20 0.54
HPGD P15428 2/20 0.54
MEN1 O00255 1/20 0.54
NTSR1 P30989 1/20 0.54
KMT2A Q03164 1/20 0.54
SMN1; SMN2 Q16637 1/20 0.54
CA12 O43570 2/20 0.54
CA9 Q16790 2/20 0.54
CA1 P00915 1/20 0.54
CA3 P07451 1/20 0.54
TSHR P16473 1/20 0.54

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
SCHEMBL28459080 1.00 MAOB (0.73) MAOBMGAMGAASIMGAM2
SCHEMBL28465556 0.89 MAOB (0.65) MAOBMGAMGAASIMGAM2
SCHEMBL28465557 0.89 MAOB (0.65) MAOBMGAMGAASIMGAM2
SCHEMBL28245355 0.86 MAOB (0.75) MAOBMGAMGAASIMGAM2
SCHEMBL28245359 0.86 MAOB (0.75) MAOBMGAMGAASIMGAM2
SCHEMBL28458708 0.85 MAOB (0.73) MAOBMGAMGAASIMGAM2
SCHEMBL28458739 0.85 MAOB (1.00) MAOBGAAMAOANPC1ALDH1A1
SCHEMBL28468115 0.84 MAOB (0.69) MAOBMGAMGAASIMGAM2
SCHEMBL28468114 0.84 MAOB (0.69) MAOBMGAMGAASIMGAM2
SCHEMBL28459726 0.82 MAOB (0.60) MAOBMGAMGAASIMGAM2

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111588718-B Alpha-glucosidase inhibitor and application thereof 五邑大学 2021-06-08 CN disclosed
CN-111588718-A Alpha-glucosidase inhibitor and application thereof 五邑大学 2020-08-28 CN disclosed