SCHEMBL28343226

SCHEMBL28343226

COC(=O)COc1ccccc1C1CC(c2ccccc2)=NN1C(C)=O

nearest known ligand 0.64

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ MAOB P27338 3/20 0.64
▸ MAOA P21397 1/20 0.64
▸ PTGS2 P35354 1/20 0.61
▸ LMNA P02545 1/20 0.56
▸ NPC1 O15118 1/20 0.55
▸ RAB9A P51151 1/20 0.55
▸ NT5E P21589 1/20 0.55
▸ ACHE P22303 3/20 0.54
▸ PKM P14618 1/20 0.54
▸ MEN1 O00255 1/20 0.53
▸ PPARG P37231 1/20 0.53
▸ KMT2A Q03164 1/20 0.53
▸ NCOA2 Q15596 1/20 0.53
▸ NCOA1 Q15788 1/20 0.53
▸ NCOA3 Q9Y6Q9 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
SCHEMBL28343220 0.91 MAOB (0.59) MAOBMAOAPTGS2MEN1PPARG
SCHEMBL28346645 0.88 MAOB (0.60) MAOBMAOAPTGS2LMNANT5E
SCHEMBL28346042 0.78 MAOB (0.52) MAOBMAOAPTGS2MEN1PPARG
SCHEMBL1658926 0.76 NT5E (0.82) MAOBNPC1RAB9ANT5EACHE
SCHEMBL14133297 0.76 ALDH1A1 (0.66) MAOBMAOAPTGS2NPC1RAB9A
SCHEMBL14133506 0.75 MAOB (0.70) MAOBMAOAPTGS2NPC1RAB9A
SCHEMBL14133755 0.75 MAOB (0.70) MAOBMAOAPTGS2NPC1RAB9A
SCHEMBL14133296 0.74 MAPT (0.81) MAOBMAOAPTGS2PKMMEN1
SCHEMBL20989157 0.74 NPSR1 (0.58) PTGS2LMNAPKMMEN1PPARG
SCHEMBL8208092 0.74 MAOB (0.72) MAOBMAOAPTGS2NPC1RAB9A

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-107827820-B Pyrazoline aminopeptidase N inhibitor and preparation method and application thereof 山东大学 2020-01-07 — — CN claimed
CN-107827820-B Pyrazoline aminopeptidase N inhibitor and preparation method and application thereof 山东大学 2020-01-07 — — CN disclosed
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