SCHEMBL30523913

SCHEMBL30523913

COc1ccc(OC)c(OB(O)O)c1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CA12 O43570 1/20 0.65
▸ CA1 P00915 1/20 0.65
▸ CA2 P00918 1/20 0.65
▸ CA7 P43166 1/20 0.65
▸ CA9 Q16790 1/20 0.65
▸ CA14 Q9ULX7 1/20 0.65
▸ ALDH1A1 P00352 6/20 0.50
▸ HPGD P15428 2/20 0.50
▸ RAD52 P43351 1/20 0.50
▸ GAA P10253 2/20 0.47
▸ CYP1A1 P04798 4/20 0.47
▸ CYP1A2 P05177 4/20 0.47
▸ CYP1B1 Q16678 4/20 0.47
▸ MAPT P10636 3/20 0.47
▸ CYP3A4 P08684 2/20 0.47
▸ MEN1 O00255 1/20 0.47
▸ THRB P10828 1/20 0.47
▸ KMT2A Q03164 1/20 0.47
▸ NFE2L2 Q16236 1/20 0.46
▸ HTT P42858 2/20 0.44

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
SCHEMBL4099192 1.00 CA12 (0.65) CA12CA1CA2CA7CA9
SCHEMBL30702417 0.92 CA12 (0.65) CA12CA1CA2CA7CA9
SCHEMBL2936012 0.92 CA12 (0.65) CA12CA1CA2CA7CA9
SCHEMBL2178296 0.86 CA2 (0.61) CA12CA1CA2CA7CA9
SCHEMBL17075740 0.81 CA1 (0.45) CA12CA1CA2CA7CA9
SCHEMBL1943729 0.81 CA1 (0.45) CA12CA1CA2CA7CA9
SCHEMBL29880696 0.81 CA1 (0.45) CA12CA1CA2CA7CA9
SCHEMBL29066818 0.81 CA1 (0.45) CA12CA1CA2CA7CA9
SCHEMBL29004580 0.81 CA1 (0.45) CA12CA1CA2CA7CA9
SCHEMBL28080378 0.81 CA1 (0.45) CA12CA1CA2CA7CA9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118652165-A Chiral binaphthyl macrocyclic arene, derivative, and synthetic method and application thereof 天津师范大学 2024-09-17 — — CN claimed
CN-119585337-A Method for preparing epoxy resin composition for material pre-impregnation 澳泽化学特罗斯特贝格有限公司 2025-03-07 — — CN disclosed
CN-115974828-B Compounds as protein phosphatase 5 agonists, methods of preparation and uses thereof 中国药科大学 2025-02-11 — — CN disclosed
WO-2024217500-A1 ISOQUINOLINE COMPOUND, AND PREPARATION METHOD THEREFOR, PHARMACEUTICAL COMPOSITION AND USE THEREOF 上海赛默罗生物科技有限公司 2024-10-24 — — WO disclosed
CN-118652165-A Chiral binaphthyl macrocyclic arene, derivative, and synthetic method and application thereof 天津师范大学 2024-09-17 — — CN disclosed
CN-116813526-A Isoindolinone compound, preparation method and application thereof 四川省医学科学院·四川省人民医院 2023-09-29 — — CN disclosed
CN-116761834-A Storage stable epoxy resin composition 澳泽化学特罗斯特贝格有限公司 2023-09-15 — — CN disclosed
CN-114207024-B Storage stable epoxy resin composition 澳泽化学特罗斯特贝格有限公司 2023-08-22 — — CN disclosed
Send feedback