SCHEMBL28458698

SCHEMBL28458698

COc1ccccc1/C=C/C(=O)c1cc2ccccc2oc1=O

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 4/20 0.69
MAOA P21397 1/20 0.63
MEN1 O00255 3/20 0.61
KMT2A Q03164 3/20 0.61
AR P10275 4/20 0.56
CYP1A1 P04798 1/20 0.56
CYP1B1 Q16678 1/20 0.56
KDM4E B2RXH2 3/20 0.55
ALDH1A1 P00352 3/20 0.55
MAPT P10636 3/20 0.55
LMNA P02545 2/20 0.55
RAB9A P51151 2/20 0.55
PLIN1 O60240 1/20 0.55
PLIN5 Q00G26 1/20 0.55
ABHD5 Q8WTS1 1/20 0.55
HPGD P15428 2/20 0.55
NR1H4 Q96RI1 4/20 0.55
NPC1 O15118 1/20 0.53
BCHE P06276 1/20 0.53
POLB P06746 1/20 0.53

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
SCHEMBL28458699 1.00 MAOB (0.69) MAOBMAOAMEN1KMT2AAR
SCHEMBL4397459 0.88 AR (0.65) MAOBMAOAMEN1KMT2AAR
SCHEMBL4397462 0.88 AR (0.65) MAOBMAOAMEN1KMT2AAR
SCHEMBL13857231 0.87 MAOB (0.67) MAOBMAOAMEN1KMT2AKDM4E
SCHEMBL28470319 0.86 MEN1 (0.65) MAOBMAOAMEN1KMT2AKDM4E
SCHEMBL28245359 0.83 MAOB (0.75) MAOBMEN1KMT2AARCYP1A1
SCHEMBL28245355 0.83 MAOB (0.75) MAOBMEN1KMT2AARCYP1A1
SCHEMBL28245362 0.82 PTGS1 (0.64) MAOBMAOAMEN1KMT2AAR
SCHEMBL28245361 0.82 PTGS1 (0.64) MAOBMAOAMEN1KMT2AAR
SCHEMBL28459080 0.81 MAOB (0.73) MAOBMAOAMEN1KMT2ACYP1A1

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