SCHEMBL28580482

SCHEMBL28580482

C=CC(C(=O)c1ccccc1)N(C)C

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.59
RECQL P46063 1/20 0.46
MAPT P10636 3/20 0.45
RAB9A P51151 3/20 0.45
NPC1 O15118 2/20 0.45
ATM Q13315 2/20 0.45
MAPK1 P28482 1/20 0.45
HTT P42858 1/20 0.45
AKT1 P31749 1/20 0.44
PGR P06401 1/20 0.43
ADRA2A P08913 1/20 0.43
ADRA2B P18089 1/20 0.43
HTR2A P28223 1/20 0.43
HRH1 P35367 1/20 0.43
KCNH2 Q12809 1/20 0.43
L3MBTL1 Q9Y468 2/20 0.42
TDP1 Q9NUW8 1/20 0.42
CES2 O00748 1/20 0.41
CES1 P23141 1/20 0.41
KDM4E B2RXH2 2/20 0.41

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
SCHEMBL27596718 0.83 LMNA (0.49) LMNARECQLMAPTRAB9ANPC1
Benzoic Acid SCHEMBL11769152 0.82 LMNA (0.49) LMNARECQLMAPTRAB9ANPC1
SCHEMBL27448144 0.78 LMNA (0.44) LMNARECQLMAPTRAB9ANPC1
SCHEMBL9093296 0.75 LMNA (0.51) LMNAMAPTRAB9ANPC1ATM
SCHEMBL27818447 0.75 LMNA (0.51) LMNARECQLMAPTRAB9ANPC1
SCHEMBL11287380 0.74 LMNA (0.54) LMNARECQLMAPTRAB9ANPC1
SCHEMBL1720153 0.74 AKT1 (0.52) LMNARECQLMAPTRAB9ANPC1
Metamfepramone SCHEMBL10505245 0.72 PGR (0.63) LMNAMAPTRAB9ANPC1ATM
Metamfepramone SCHEMBL309430 0.72 PGR (0.63) LMNAMAPTRAB9ANPC1ATM
SCHEMBL28682238 0.72 PGR (0.53) LMNARECQLMAPTRAB9ANPC1

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-112961138-B Polysubstituted chromone derivative and synthetic method thereof 齐鲁工业大学 2022-11-08 CN disclosed
CN-112961138-A Polysubstituted chromone derivative and synthetic method thereof 齐鲁工业大学 2021-06-15 CN disclosed