SCHEMBL30366304

SCHEMBL30366304

COc1ccc(C(O)C(C)O)cc1OC

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARG P37231 1/20 0.66
PPARD Q03181 1/20 0.66
PPARA Q07869 1/20 0.66
ACHE P22303 3/20 0.60
CYP1A2 P05177 1/20 0.54
CYP2C9 P11712 1/20 0.54
CYP2C19 P33261 1/20 0.54
KMT2A Q03164 1/20 0.54
NPSR1 Q6W5P4 1/20 0.54
L3MBTL1 Q9Y468 1/20 0.54
TUBB4A P04350 2/20 0.53
TUBB P07437 2/20 0.53
TUBA3C P0DPH7 2/20 0.53
TUBA1B P68363 2/20 0.53
TUBA4A P68366 2/20 0.53
TUBB4B P68371 2/20 0.53
TUBB3 Q13509 2/20 0.53
TUBB2A Q13885 2/20 0.53
TUBB8 Q3ZCM7 2/20 0.53
TUBA3E Q6PEY2 2/20 0.53

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
SCHEMBL28957718 1.00 PPARG (0.66) PPARGPPARDPPARAACHECYP1A2
SCHEMBL758673 0.90 PPARG (0.68) PPARGPPARDPPARAACHECYP1A2
SCHEMBL10343408 0.88 PPARG (0.66) PPARGPPARDPPARAACHECYP1A2
SCHEMBL15004032 0.85 PPARG (0.54) PPARGPPARDPPARAACHECYP1A2
SCHEMBL3659342 0.85 ACHE (0.66) PPARGPPARDPPARAACHECYP1A2
SCHEMBL11197069 0.85 TSHR (0.62) ACHENPSR1TUBB4ATUBBTUBA3C
SCHEMBL19730093 0.85 PPARG (0.49) PPARGPPARDPPARAACHECYP1A2
SCHEMBL28252970 0.85 PPARG (0.62) PPARGPPARDPPARAACHECYP1A2
SCHEMBL10774314 0.85 ACHE (0.66) PPARGPPARDPPARAACHECYP1A2
SCHEMBL670305 0.83 PPARG (0.59) PPARGPPARDPPARAACHECYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4408967-A1 BRANDY REPLICAS AVA FOOD LABS, INC. (US) 2024-08-07 EP disclosed
CN-118339274-A Brandy replica 艾娃食品实验室股份有限公司 2024-07-12 CN disclosed
WO-2023055801-A1 BRANDY REPLICAS AVA FOOD LABS, INC. (US) 2023-04-06 WO disclosed