SCHEMBL1894065

SCHEMBL1894065

CCOC(=O)C=Cc1ccc(C)cc1

nearest known ligand 0.77

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 1/20 0.77
CA1 P00915 1/20 0.77
CA2 P00918 1/20 0.77
CA7 P43166 1/20 0.77
CA9 Q16790 1/20 0.77
CA14 Q9ULX7 1/20 0.77
CYP3A4 P08684 2/20 0.67
TTR P02766 1/20 0.66
DPP4 P27487 1/20 0.66
MAOB P27338 2/20 0.59
FDPS P14324 1/20 0.56
MAPT P10636 3/20 0.55
RAB9A P51151 2/20 0.53
KMT2A Q03164 1/20 0.53
FOS P01100 1/20 0.51
JUN P05412 1/20 0.51
POLB P06746 1/20 0.51
ESR1 P03372 1/20 0.51
NPC1 O15118 1/20 0.50
APP P05067 1/20 0.50

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
SCHEMBL1894062 1.00 CA12 (0.77) CA12CA1CA2CA7CA9
SCHEMBL13957155 1.00 CA12 (0.77) CA12CA1CA2CA7CA9
SCHEMBL5059085 0.94 CA12 (0.86) CA12CA1CA2CA7CA9
SCHEMBL10939791 0.94 CA12 (0.86) CA12CA1CA2CA7CA9
SCHEMBL13957401 0.94 CA12 (0.86) CA12CA1CA2CA7CA9
SCHEMBL1260527 0.92 CA12 (0.83) CA12CA1CA2CA7CA9
SCHEMBL3143890 0.92 CA12 (0.83) CA12CA1CA2CA7CA9
SCHEMBL2075719 0.92 CA12 (0.67) CA12CA1CA2CA7CA9
SCHEMBL20857445 0.92 CA12 (0.67) CA12CA1CA2CA7CA9
SCHEMBL10505915 0.92 CA12 (0.67) 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 78 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112067718-B Establishment method of muskiness rheumatalgia-relieving plaster volatile component fingerprint, standard fingerprint and application thereof 重庆希尔安药业有限公司 2022-07-29 CN claimed
CN-109796338-B Synthetic method of ozagrel intermediate p-bromomethyl cinnamate 深圳市第二人民医院 2022-05-06 CN claimed
CN-112067718-A Establishment method of muskiness rheumatalgia-relieving plaster volatile component fingerprint, standard fingerprint and application thereof 重庆希尔安药业有限公司 2020-12-11 CN claimed
EP-1100432-B1 NOVEL USES OF ASCORBYL-PHOSPHORYL-CHOLESTEROL AND COMPOSITIONS FOR PRACTICING SAME AVON PROD INC (US) 2007-12-19 EP claimed
EP-1100432-A4 NOVEL USES OF ASCORBYL-PHOSPHORYL-CHOLESTEROL AND COMPOSITIONS FOR PRACTICING SAME AVON PROD INC (US) 2003-06-04 EP claimed
EP-1100432-A1 NOVEL USES OF ASCORBYL-PHOSPHORYL-CHOLESTEROL AND COMPOSITIONS FOR PRACTICING SAME AVON PRODUCTS, INC. (US) 2001-05-23 EP claimed
US-6162450-A Uses of ascorbyl-phosphoryl-cholesterol and compositions for practicing same AVON PRODUCTS, INC. (US) 2000-12-19 US claimed
WO-2000006091-A1 NOVEL USES OF ASCORBYL-PHOSPHORYL-CHOLESTEROL AND COMPOSITIONS FOR PRACTICING SAME AVON PRODUCTS, INC. (US) 2000-02-10 WO claimed
CN-115141098-B Method for preparing ozagrel intermediate through microchannel reaction 赤峰经方医药技术开发有限责任公司 2024-10-15 CN disclosed
CN-112794837-B Synthesis method of heterochroman compound 云南大学 2023-05-23 CN disclosed
CN-116135861-A Method for preparing boronated carbonyl derivative from alpha, beta-unsaturated carbonyl derivative 中国科学院大连化学物理研究所 2023-05-19 CN disclosed
CN-115141098-A Method for preparing ozagrel intermediate through microchannel reaction 赤峰经方医药技术开发有限责任公司 2022-10-04 CN disclosed
CN-112067718-B Establishment method of muskiness rheumatalgia-relieving plaster volatile component fingerprint, standard fingerprint and application thereof 重庆希尔安药业有限公司 2022-07-29 CN disclosed
CN-114436964-A Continuous preparation method of ozagrel 赤峰经方医药技术开发有限责任公司 2022-05-06 CN disclosed
US-5043510-A Aqueous alkylation process E. I. DU PONT DE NEMOURS AND COMPANY (US) 1991-08-27 US disclosed
US-4335054-A Process for the preparation of alkenylbenzenecarboxylic acid derivatives and alkenylnaphthalenecarboxylic acid derivatives CIBA-GEIGY CORPORATION (US) 1982-06-15 US disclosed
US-4260771-A VASODILATORS, ANTICOAGULANTS, IMMUNOLOGY MERCK & CO., INC. (US) 1981-04-07 US disclosed
US-4175203-A TREATMENT OF RENAL FAILURE AND TRANSPLANT REJECTION VASODILATORS MERCK & CO., INC. (US) 1979-11-20 US disclosed
US-4150235-A ANTIBODY INHIBITORS, HYPOTENSIVE AGENTS, DIURETICS, VASODILATOR MERCK & CO., INC. (US) 1979-04-17 US disclosed
US-4140861-A RENAL DISFUNCTION, ANTIBODY INHIBITORS MERCK & CO., INC. (US) 1979-02-20 US disclosed