SCHEMBL28902174

SCHEMBL28902174

COc1ccc(NCc2coc3cc(O)ccc3c2=O)cc1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.60
ALDH1A1 P00352 3/20 0.60
CYP3A4 P08684 3/20 0.60
HPGD P15428 3/20 0.60
HSD17B10 Q99714 3/20 0.60
MAOA P21397 3/20 0.60
MAOB P27338 3/20 0.60
MEN1 O00255 3/20 0.60
KMT2A Q03164 3/20 0.60
MAPT P10636 2/20 0.60
SMN1; SMN2 Q16637 2/20 0.60
TP53 P04637 1/20 0.60
BCL2 P10415 1/20 0.60
CYP2D6 P10635 1/20 0.60
CYP2C9 P11712 1/20 0.60
CYP2C19 P33261 1/20 0.60
IL2 P60568 1/20 0.60
CYP1B1 Q16678 1/20 0.60
HDAC6 Q9UBN7 1/20 0.60
PPARG P37231 2/20 0.54

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
SCHEMBL28902171 0.89 MAOA (0.55) KDM4EALDH1A1CYP3A4HPGDHSD17B10
SCHEMBL28902185 0.88 PPARG (0.59) KDM4EALDH1A1CYP3A4HPGDHSD17B10
SCHEMBL28902165 0.86 MAOB (0.53) KDM4EALDH1A1HPGDHSD17B10MAOA
SCHEMBL28874647 0.84 MAOB (0.56) KDM4EALDH1A1CYP3A4HPGDHSD17B10
SCHEMBL28902175 0.84 KDM4E (0.57) KDM4EALDH1A1CYP3A4HPGDHSD17B10
SCHEMBL28902193 0.84 MAOB (0.52) KDM4EALDH1A1CYP3A4HPGDHSD17B10
SCHEMBL28960196 0.84 KDM4E (0.54) KDM4EALDH1A1CYP3A4HPGDHSD17B10
SCHEMBL28902168 0.84 HSD17B3 (0.63) KDM4EALDH1A1CYP3A4HPGDHSD17B10
SCHEMBL30167104 0.84 HSD17B3 (0.63) KDM4EALDH1A1CYP3A4HPGDHSD17B10
SCHEMBL28902182 0.83 MAOB (0.74) KDM4EALDH1A1HSD17B10MAOAMAOB

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