Marmesin

Marmesin

SCHEMBL503874

CC(C)(O)C1Cc2cc3ccc(=O)oc3cc2O1.O=c1ccc2ccc(O)cc2o1

nearest known ligand 0.86

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ACHE P22303 3/20 0.86
▸ NPC1 O15118 1/20 0.86
▸ ALDH1A1 P00352 5/20 0.69
▸ HPGD P15428 5/20 0.69
▸ GAA P10253 5/20 0.69
▸ KDM4E B2RXH2 4/20 0.69
▸ HSD17B10 Q99714 2/20 0.65
▸ HIF1A Q16665 10/20 0.61
▸ L3MBTL1 Q9Y468 2/20 0.60
▸ LMNA P02545 1/20 0.56
▸ RAB9A P51151 1/20 0.56
▸ MEN1 O00255 1/20 0.54
▸ CA12 O43570 1/20 0.54
▸ CA1 P00915 1/20 0.54
▸ GLA P06280 1/20 0.54
▸ AKR1B1 P15121 1/20 0.54
▸ CASP1 P29466 1/20 0.54
▸ CASP7 P55210 1/20 0.54
▸ KMT2A Q03164 1/20 0.54
▸ MCL1 Q07820 1/20 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
Marmesin SCHEMBL12062107 0.93 ACHE (1.00) ACHENPC1ALDH1A1HPGDGAA
Marmesin SCHEMBL30977125 0.93 ACHE (1.00) ACHENPC1ALDH1A1HPGDGAA
Marmesin SCHEMBL546574 0.93 ACHE (1.00) ACHENPC1ALDH1A1HPGDGAA
Marmesin SCHEMBL29471037 0.93 ACHE (1.00) ACHENPC1ALDH1A1HPGDGAA
Marmesin Acetate SCHEMBL2257271 0.79 ALDH1A1 (1.00) ACHENPC1ALDH1A1HPGDGAA
Marmesin Acetate SCHEMBL12062110 0.79 ALDH1A1 (1.00) ACHENPC1ALDH1A1HPGDGAA
SCHEMBL30777266 0.79 ALDH1A1 (0.71) ACHENPC1ALDH1A1HPGDGAA
(-)-Prantschimgin SCHEMBL13337338 0.75 ALDH1A1 (0.78) ACHENPC1ALDH1A1HPGDGAA
Felamidin SCHEMBL30467160 0.75 ALDH1A1 (0.75) ACHENPC1ALDH1A1HPGDGAA
Felamidin SCHEMBL12062114 0.75 ALDH1A1 (0.75) ACHENPC1ALDH1A1HPGDGAA

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180207218-A1 PLANT EXTRACTIONS, COMPOSITIONS CONTAINING SAME, AND USES THEREOF DEO NAMITA (US) 2018-07-26 — — US disclosed
US-20160074460-A1 PLANT EXTRACTIONS, COMPOSITIONS CONTAINING SAME, AND USES THEREOF DEO NAMITA (US) 2016-03-17 — — US disclosed
US-20120027697-A1 PLANT EXTRACTS, COMPOSITIONS CONTAINING SAME, AND USES THEREOF DEO NAMITA (US) 2012-02-02 — — US disclosed
WO-2011119592-A1 PLANT EXTRACTS, COMPOSITIONS CONTAINING SAME, AND USES THEREOF DEO NAMITA (US) 2011-09-29 — — WO disclosed
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