SCHEMBL28239226

SCHEMBL28239226

O=COS(=O)(=O)Oc1cccc2cc3ccccc3cc12

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.36
KDM4E B2RXH2 3/20 0.36
GAA P10253 3/20 0.36
TUBB4A P04350 1/20 0.35
TUBB P07437 1/20 0.35
TUBA3C P0DPH7 1/20 0.35
TUBA1B P68363 1/20 0.35
TUBA4A P68366 1/20 0.35
TUBB4B P68371 1/20 0.35
TUBB3 Q13509 1/20 0.35
TUBB2A Q13885 1/20 0.35
TUBB8 Q3ZCM7 1/20 0.35
TUBA3E Q6PEY2 1/20 0.35
TUBA1A Q71U36 1/20 0.35
TUBA1C Q9BQE3 1/20 0.35
TUBB6 Q9BUF5 1/20 0.35
TUBB2B Q9BVA1 1/20 0.35
TUBB1 Q9H4B7 1/20 0.35
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33

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
SCHEMBL28183818 0.87 ALDH1A1 (0.42) ALDH1A1KDM4EGAATUBB4ATUBB
SCHEMBL3203462 0.85 ALDH1A1 (0.41) ALDH1A1KDM4EGAACA1CA2
Formaldehyde SCHEMBL28164742 0.83 ALDH1A1 (0.40) ALDH1A1KDM4EGAATUBB4ATUBB
SCHEMBL3482649 0.82 ALDH1A1 (0.43) ALDH1A1KDM4EGAAKMT2AMEN1
SCHEMBL1219595 0.81 ALDH1A1 (0.38) ALDH1A1KDM4EGAATUBB4ATUBB
Benzoquinone SCHEMBL27591770 0.79 ALDH1A1 (0.37) ALDH1A1KDM4EGAATUBB4ATUBB
SCHEMBL27593563 0.77 ALDH1A1 (0.40) ALDH1A1KDM4EGAATUBB4ATUBB
SCHEMBL27611667 0.77 ALDH1A1 (0.43) ALDH1A1KDM4EGAATUBB4ATUBB
SCHEMBL20509016 0.77 TUBB4A (0.42) ALDH1A1KDM4EGAATUBB4ATUBB
SCHEMBL27611768 0.77 TUBB4A (0.42) ALDH1A1KDM4EGAATUBB4ATUBB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115152845-A Natural dairy product endogenous stabilizer and application thereof 王天明 2022-10-11 CN disclosed
CN-114878490-A Method for detecting quality of seaweed beta glucan for injection 正大制药(青岛)有限公司 2022-08-09 CN disclosed
CN-114858788-A Method for measuring content of cassia twig and poria cocos capsule polysaccharide 江苏康缘药业股份有限公司 2022-08-05 CN disclosed
CN-109010385-A A kind of preparation method of glossy ganoderma powder 杭州康力食品有限公司 2018-12-18 CN disclosed
CN-108496669-A A kind of ecology planting method of selenium-rich blue or green money willow picking leaves woods 桂林市林业科学研究所 2018-09-07 CN disclosed