SCHEMBL29426237

SCHEMBL29426237

C[C@@]1(O)C2C(C[C@@H]1O)C(C(=O)O)=CO[C@H]2O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O

nearest known ligand 0.63

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 2/20 0.63
▸ POLB P06746 1/20 0.52
▸ CTDSP1 Q9GZU7 1/20 0.52
▸ STAT3 P40763 14/20 0.52
▸ MEN1 O00255 1/20 0.46
▸ KMT2A Q03164 1/20 0.46

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
SCHEMBL2636258 0.84 MAPT (0.61) MAPTPOLBCTDSP1STAT3MEN1
SCHEMBL29425733 0.82 MAPT (0.56) MAPTPOLBCTDSP1STAT3MEN1
SCHEMBL29425778 0.80 POLB (0.65) MAPTPOLBCTDSP1STAT3MEN1
SCHEMBL29425884 0.80 POLB (0.65) MAPTPOLBCTDSP1STAT3MEN1
Shanzhiside SCHEMBL306203 0.80 MAPT (0.58) MAPTPOLBCTDSP1STAT3MEN1
Loganic Acid SCHEMBL308008 0.78 MAPT (1.00) MAPTSTAT3MEN1KMT2A
Loganic Acid SCHEMBL29426077 0.78 MAPT (1.00) MAPTSTAT3MEN1KMT2A
Loganic Acid SCHEMBL31179995 0.78 MAPT (1.00) MAPTSTAT3MEN1KMT2A
SCHEMBL20572414 0.77 MAPT (0.74) MAPTSTAT3MEN1KMT2A
SCHEMBL29351043 0.77 MAPT (0.71) MAPTSTAT3MEN1KMT2A

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
EP-3409766-B1 AN ESTERASE THAT IS CAPABLE OF CONVERTING IRIDOIDS AND SECO-IRIDOIDS N ZYME BIOTEC GMBH (DE) 2022-03-09 — — EP disclosed
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