SCHEMBL28902171

SCHEMBL28902171

CCOc1ccc(NCc2coc3cc(O)ccc3c2=O)cc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAOA P21397 3/20 0.55
▸ MAOB P27338 3/20 0.55
▸ ALDH2 P05091 1/20 0.55
▸ MAPT P10636 5/20 0.51
▸ ALDH1A1 P00352 4/20 0.51
▸ KDM4E B2RXH2 4/20 0.51
▸ HPGD P15428 3/20 0.51
▸ HSD17B10 Q99714 3/20 0.51
▸ MAPK1 P28482 1/20 0.51
▸ NPC1 O15118 2/20 0.49
▸ RAB9A P51151 2/20 0.49
▸ KMT2A Q03164 5/20 0.47
▸ MEN1 O00255 4/20 0.46
▸ CYP3A4 P08684 2/20 0.46
▸ TP53 P04637 1/20 0.46
▸ BCL2 P10415 1/20 0.46
▸ CYP2D6 P10635 1/20 0.46
▸ CYP2C9 P11712 1/20 0.46
▸ CYP2C19 P33261 1/20 0.46
▸ IL2 P60568 1/20 0.46

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
SCHEMBL28902174 0.89 KDM4E (0.60) MAOAMAOBMAPTALDH1A1KDM4E
SCHEMBL28902165 0.84 MAOB (0.53) MAOAMAOBALDH1A1KDM4EHPGD
SCHEMBL28902192 0.84 MAOB (0.71) MAOAMAOBMAPTALDH1A1KDM4E
SCHEMBL28902193 0.82 MAOB (0.52) MAOAMAOBALDH2MAPTALDH1A1
SCHEMBL28902175 0.82 KDM4E (0.57) MAOAMAOBALDH2MAPTALDH1A1
SCHEMBL28874647 0.82 MAOB (0.56) MAOAMAOBALDH2MAPTALDH1A1
SCHEMBL28902168 0.82 HSD17B3 (0.63) MAOAMAOBALDH2MAPTALDH1A1
SCHEMBL30167104 0.82 HSD17B3 (0.63) MAOAMAOBALDH2MAPTALDH1A1
SCHEMBL28902187 0.81 ALDH1A1 (0.63) MAOAMAOBALDH2MAPTALDH1A1
SCHEMBL28960194 0.80 MAOB (0.49) MAOAMAOBALDH2MAPTALDH1A1

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-115246805-B Chromone-aniline alpha-glucosidase inhibitor and preparation method and application thereof 贵州医科大学 2024-01-19 — — CN disclosed
CN-115246805-A Chromone-aniline alpha-glucosidase inhibitor and preparation method and application thereof 贵州医科大学 2022-10-28 — — CN disclosed
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