SCHEMBL29022698

SCHEMBL29022698

CCCCCCOc1ccc(NC(=O)c2cc3ccc(OC)cc3oc2=O)cc1

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 12/20 0.69
MAOA P21397 4/20 0.69
LMNA P02545 1/20 0.66
POLB P06746 1/20 0.66
CA12 O43570 2/20 0.64
CA2 P00918 2/20 0.64
CA4 P22748 2/20 0.64
CA7 P43166 2/20 0.64
CA1 P00915 1/20 0.64
CA5A P35218 1/20 0.64
CA5B Q9Y2D0 1/20 0.64
HPGD P15428 4/20 0.59
KDM4E B2RXH2 3/20 0.59
ALDH1A1 P00352 3/20 0.59
GAA P10253 3/20 0.59
GLA P06280 2/20 0.59
HSD17B10 Q99714 1/20 0.59
MEN1 O00255 1/20 0.58
KMT2A Q03164 1/20 0.58
SMN1; SMN2 Q16637 1/20 0.58

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
SCHEMBL29022700 1.00 MAOB (0.69) MAOBMAOALMNAPOLBCA12
SCHEMBL29022725 1.00 MAOB (0.69) MAOBMAOALMNAPOLBCA12
SCHEMBL7340338 0.82 MAOB (1.00) MAOBMAOACA12CA2CA4
SCHEMBL27750409 0.82 MAOB (1.00) MAOBMAOACA12CA2CA4
SCHEMBL4532212 0.81 MAOB (0.72) MAOBMAOACA12CA2CA4
SCHEMBL28918835 0.81 MAOB (0.77) MAOBMAOACA12CA2CA4
SCHEMBL3881711 0.81 MAOB (0.68) MAOBMAOACA12CA2CA4
SCHEMBL7334631 0.80 MAOB (0.79) MAOBMAOACA12CA2CA4
SCHEMBL27771306 0.80 MAOB (0.79) MAOBMAOACA12CA2CA4
SCHEMBL31206415 0.79 MAOB (0.77) MAOBMAOACA12CA2CA4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115109021-B Synthesis of N- (4-alkoxyphenyl) -7-methoxycoumarin-3-carboxamide, gel prepared by same and application thereof 天津大学 2023-09-12 CN claimed
CN-115109021-A Synthesis of N- (4-alkoxy phenyl) -7-methoxy coumarin-3-formamide, gel prepared from N- (4-alkoxy phenyl) -7-methoxy coumarin-3-formamide and application of gel 天津大学 2022-09-27 CN claimed
CN-115109021-B Synthesis of N- (4-alkoxyphenyl) -7-methoxycoumarin-3-carboxamide, gel prepared by same and application thereof 天津大学 2023-09-12 CN disclosed
CN-115109021-A Synthesis of N- (4-alkoxy phenyl) -7-methoxy coumarin-3-formamide, gel prepared from N- (4-alkoxy phenyl) -7-methoxy coumarin-3-formamide and application of gel 天津大学 2022-09-27 CN disclosed