SCHEMBL28773473

SCHEMBL28773473

CC(=O)OC1C=CC(=C=O)CO1

nearest known ligand 0.35

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
NLRP3 Q96P20 1/20 0.35
TSHR P16473 1/20 0.30

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
SCHEMBL2951827 0.78 NLRP3 (0.55) NLRP3
SCHEMBL2951820 0.78 NLRP3 (0.55) NLRP3
SCHEMBL1567471 0.66
SCHEMBL29058931 0.66 NLRP3 (0.39) NLRP3
SCHEMBL21339578 0.65 POLB (0.34) NLRP3
SCHEMBL981868 0.65 POLB (0.34) NLRP3
SCHEMBL1867848 0.65 NLRP3 (0.33) NLRP3
SCHEMBL21339663 0.63 NPC1 (0.33)
SCHEMBL18306706 0.63 NPC1 (0.31) NLRP3TSHR
SCHEMBL10571332 0.62 NLRP3 (0.45) NLRP3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114409664-B Spiro heterocyclic tetrahydropyran compound and preparation method and application thereof 河北威远生物化工有限公司 2023-07-18 CN claimed
CN-114409664-A Spiro-heterocyclic tetrahydropyran compound and preparation method and application thereof 河北威远生物化工有限公司 2022-04-29 CN claimed
CN-114409664-B Spiro heterocyclic tetrahydropyran compound and preparation method and application thereof 河北威远生物化工有限公司 2023-07-18 CN disclosed
CN-114409664-A Spiro-heterocyclic tetrahydropyran compound and preparation method and application thereof 河北威远生物化工有限公司 2022-04-29 CN disclosed