SCHEMBL12474858

SCHEMBL12474858

CC(=O)O[C@@H]1C[C@@]2(C)C(CC[C@]3(C)[C@@H]2CC=C2[C@@H]4[C@](C(=O)O)(CC[C@@H](C)[C@@]4(C)O)CC[C@]23C)C(C)(C)[C@H]1O

nearest known ligand 0.77

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SENP1 Q9P0U3 2/20 0.77
PTPN1 P18031 5/20 0.70
HSD11B1 P28845 2/20 0.69
ACHE P22303 1/20 0.68
GYS2 P54840 1/20 0.64
POLB P06746 2/20 0.60
PYGM P11217 1/20 0.57
PTPN2 P17706 1/20 0.57
PTPN6 P29350 1/20 0.57
HTT P42858 1/20 0.57
GPBAR1 Q8TDU6 1/20 0.57
USP7 Q93009 1/20 0.57

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
Euscaphic Acid SCHEMBL29228689 0.87 SENP1 (1.00) SENP1PTPN1HSD11B1ACHEPOLB
Euscaphic Acid SCHEMBL126037 0.87 SENP1 (1.00) SENP1PTPN1HSD11B1ACHEPOLB
Euscaphic Acid SCHEMBL7349266 0.87 SENP1 (1.00) SENP1PTPN1HSD11B1ACHEPOLB
Tomentic Acid SCHEMBL94231 0.87 SENP1 (1.00) SENP1PTPN1HSD11B1ACHEPOLB
Euscaphic Acid SCHEMBL5971379 0.87 SENP1 (1.00) SENP1PTPN1HSD11B1ACHEPOLB
Euscaphic Acid SCHEMBL869457 0.87 SENP1 (1.00) SENP1PTPN1HSD11B1ACHEPOLB
Euscaphic Acid SCHEMBL17584886 0.87 SENP1 (1.00) SENP1PTPN1HSD11B1ACHEPOLB
Euscaphic Acid SCHEMBL5799713 0.87 SENP1 (1.00) SENP1PTPN1HSD11B1ACHEPOLB
Euscaphic Acid SCHEMBL13629633 0.87 SENP1 (1.00) SENP1PTPN1HSD11B1ACHEPOLB
Euscaphic Acid SCHEMBL7349271 0.87 SENP1 (1.00) SENP1PTPN1HSD11B1ACHEPOLB

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-113178226-B Method for resisting Alzheimer's disease by cherokee rose fruit triterpene compounds 沈阳化工大学 2024-04-26 CN disclosed
WO-2012107202-A1 SWEETENER, SWEETENER COMPOSITIONS, METHODS OF MAKING THE SAME AND CONSUMABLES CONTAINING THE SAME NUTRINOVA NUTRITION SPECIALTIES & FOOD INGREDIENTS GMBH (DE) 2012-08-16 WO disclosed