SCHEMBL31438609

SCHEMBL31438609

CC(=O)OC(C)(C)[C@@H]1Cc2c(ccc3ccc(=O)oc23)O1

nearest known ligand 0.79

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 10/20 0.79
▸ HPGD P15428 9/20 0.79
▸ ALDH1A1 P00352 8/20 0.79
▸ LMNA P02545 1/20 0.79
▸ ABCB1 P08183 1/20 0.79
▸ GAA P10253 2/20 0.74
▸ HSD17B10 Q99714 3/20 0.63
▸ CYP3A4 P08684 2/20 0.50
▸ MAPT P10636 2/20 0.50
▸ L3MBTL1 Q9Y468 1/20 0.49
▸ POLB P06746 1/20 0.47
▸ NPY1R P25929 1/20 0.47
▸ HTT P42858 1/20 0.47
▸ NPY2R P49146 1/20 0.47
▸ DPP4 P27487 2/20 0.43
▸ TRPM5 Q9NZQ8 1/20 0.43
▸ ACHE P22303 1/20 0.43
▸ NPC1 O15118 1/20 0.43
▸ CA9 Q16790 2/20 0.40

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
SCHEMBL12247775 1.00 KDM4E (0.79) KDM4EHPGDALDH1A1LMNAABCB1
Columbianadin SCHEMBL27844678 0.89 KDM4E (1.00) KDM4EHPGDALDH1A1LMNAABCB1
Columbianadin SCHEMBL14424509 0.89 KDM4E (1.00) KDM4EHPGDALDH1A1LMNAABCB1
Columbianetin SCHEMBL21527679 0.85 KDM4E (1.00) KDM4EHPGDALDH1A1LMNAABCB1
Columbianetin SCHEMBL20356593 0.85 KDM4E (1.00) KDM4EHPGDALDH1A1LMNAABCB1
Columbianetin SCHEMBL50251 0.85 KDM4E (1.00) KDM4EHPGDALDH1A1LMNAABCB1
Marmesin Acetate SCHEMBL12062110 0.77 ALDH1A1 (1.00) KDM4EHPGDALDH1A1LMNAABCB1
Marmesin Acetate SCHEMBL2257271 0.77 ALDH1A1 (1.00) KDM4EHPGDALDH1A1LMNAABCB1
SCHEMBL27920952 0.76 KDM4E (0.68) KDM4EHPGDALDH1A1LMNAABCB1
SCHEMBL31349688 0.69 KDM4E (0.81) KDM4EHPGDALDH1A1LMNAABCB1

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-119523972-A Compound capable of reducing accumulation of advanced glycosylation end products 上海青颜博识生物技术有限公司 2025-02-28 — — CN disclosed
CN-119488445-A Use of furobenzopyrone derivatives for the preparation of products with reduced accumulation of advanced glycation end products 北京青颜博识健康管理有限公司 2025-02-21 — — CN disclosed
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