SCHEMBL29624112

SCHEMBL29624112

CC/C(=C\C(=O)OC)CC/C=C(\CC)CC[C@H]1O[C@@]1(C)CC

nearest known ligand 0.00

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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
SCHEMBL29722814 0.91 LSS (0.35)
SCHEMBL7709823 0.91 LSS (0.35)
SCHEMBL8767062 0.91 LSS (0.35)
SCHEMBL7709819 0.91 LSS (0.35)
SCHEMBL729982 0.84 LSS (0.32)
SCHEMBL30276139 0.81
SCHEMBL11852495 0.80 LSS (0.34)
SCHEMBL11852498 0.80 LSS (0.34)
SCHEMBL6324145 0.79 KDM4E (0.44)
SCHEMBL119229 0.79 LSS (0.46)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111340383-B Method and system for dynamically adjusting schedule plan of assembly component under random disturbance 中国船舶工业综合技术经济研究院 2023-09-15 CN claimed
CN-114437954-B Bacillus curvatus for degrading sulfonated drilling fluid, mixed bacteria and application thereof 中国石油天然气集团有限公司 2024-09-27 CN disclosed
CN-114717170-B Host cell for heterologous synthesis of flavonoid compounds and application thereof 中国科学院分子植物科学卓越创新中心 2024-06-04 CN disclosed
CN-111340383-B Method and system for dynamically adjusting schedule plan of assembly component under random disturbance 中国船舶工业综合技术经济研究院 2023-09-15 CN disclosed
CN-115498626-A Boundary key hyperplane refinement identification method for static security domain of power distribution network 天津大学 2022-12-20 CN disclosed
WO-2022148377-A1 HOST CELL OF HETEROLOGOUS SYNTHETIC FLAVONOID COMPOUND, AND USE THEREOF 中国科学院分子植物科学卓越创新中心 2022-07-14 WO disclosed
CN-114717170-A Host cell for heterogeneously synthesizing flavonoid compound and application thereof 中国科学院分子植物科学卓越创新中心 2022-07-08 CN disclosed
CN-216687805-U Ultrapure water preparation system 四川省诚德蓝天环保科技有限公司 2022-06-07 CN disclosed
CN-114437954-A Bacillus flexus for degrading sulfonated drilling fluid, mixed bacteria and application of bacillus flexus 中国石油天然气集团有限公司 2022-05-06 CN disclosed