SCHEMBL30786757

SCHEMBL30786757

COc1cc(O)c2c(=O)c3cc(OC)ccc3oc2c1

nearest known ligand 0.84

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MGAM O43451 5/20 0.84
MAOA P21397 9/20 0.75
KDM4E B2RXH2 3/20 0.67
ALDH1A1 P00352 3/20 0.67
MAPT P10636 3/20 0.67
HPGD P15428 3/20 0.67
NPC1 O15118 1/20 0.67
CASP3 P42574 1/20 0.67
RAB9A P51151 1/20 0.67
SMN1; SMN2 Q16637 1/20 0.67
SENP8 Q96LD8 1/20 0.67
SENP7 Q9BQF6 1/20 0.67
SENP6 Q9GZR1 1/20 0.67
LMNA P02545 1/20 0.67
MAOB P27338 2/20 0.64
ACHE P22303 1/20 0.64
GAA P10253 1/20 0.59
SI P14410 1/20 0.59
MGAM2 Q2M2H8 1/20 0.59
ESR1 P03372 1/20 0.59

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
SCHEMBL15918267 1.00 MGAM (0.84) MGAMMAOAKDM4EALDH1A1MAPT
SCHEMBL30346426 0.93 MGAM (0.73) MGAMMAOAKDM4EALDH1A1MAPT
SCHEMBL6907196 0.93 MGAM (0.73) MGAMMAOAKDM4EALDH1A1MAPT
SCHEMBL29405133 0.91 MGAM (1.00) MGAMMAOAKDM4EALDH1A1MAPT
SCHEMBL996402 0.91 MGAM (1.00) MGAMMAOAKDM4EALDH1A1MAPT
SCHEMBL29397329 0.91 MGAM (1.00) MGAMMAOAKDM4EALDH1A1MAPT
SCHEMBL28380092 0.86 MAOA (1.00) MGAMMAOAKDM4EALDH1A1MAPT
SCHEMBL30346193 0.86 MAOA (0.67) MGAMMAOAKDM4EALDH1A1MAPT
SCHEMBL20356594 0.86 MAOA (0.67) MGAMMAOAKDM4EALDH1A1MAPT
SCHEMBL30015278 0.85 MGAM (0.74) MGAMMAOAKDM4EALDH1A1MAPT

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-119985664-A Research method of specific distribution of multi-component complex system in animal tissue based on mass spectrum imaging and multivariate statistical analysis 中国人民解放军海军军医大学 2025-05-13 CN disclosed
CN-117224598-A Traditional Chinese medicine preparation for treating insomnia and preparation method thereof 甘肃铭悦生物医药科技有限公司 2023-12-15 CN disclosed