SCHEMBL29022992

SCHEMBL29022992

C=CCOC(C)C1(C(=O)O)CCCCC1C(=O)O

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
SCHEMBL3020198 0.80
SCHEMBL1595554 0.75 HSD11B1 (0.32)
SCHEMBL27498299 0.74 SLC1A2 (0.35)
SCHEMBL5647514 0.73 SLC1A2 (0.33)
SCHEMBL23121550 0.73
SCHEMBL29083272 0.72
SCHEMBL17766269 0.72 CYP1A2 (0.35)
SCHEMBL475655 0.70 GRM2 (0.34)
SCHEMBL7061362 0.70
SCHEMBL461925 0.69

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116348522-A Alkali-soluble resin containing polymerizable unsaturated group, photosensitive resin composition containing the resin as essential component, and cured product thereof 日铁化学材料株式会社 2023-06-27 CN disclosed