SCHEMBL8771540

SCHEMBL8771540

COOC1O[C@H](C)[C@H](O)[C@H](O)[C@H]1O

nearest known ligand 0.52

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ FUCA1 P04066 2/20 0.35
▸ AMY1A P0DUB6 1/20 0.34
▸ CA9 Q16790 3/20 0.33
▸ CA12 O43570 2/20 0.33
▸ KDM4E B2RXH2 1/20 0.33
▸ ALDH1A1 P00352 1/20 0.33
▸ HPGD P15428 1/20 0.33
▸ CA2 P00918 1/20 0.33
▸ AKR1B1 P15121 1/20 0.33
▸ M6PR P20645 1/20 0.32
▸ FASN P49327 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
SCHEMBL10268031 0.81 M6PR (0.44) FUCA1AMY1ACA9CA12CA2
SCHEMBL13510798 0.81 M6PR (0.44) FUCA1AMY1ACA9CA12CA2
SCHEMBL9611968 0.81 M6PR (0.44) FUCA1AMY1ACA9CA12CA2
SCHEMBL2743468 0.81 M6PR (0.44) FUCA1AMY1ACA9CA12CA2
SCHEMBL16726423 0.81 M6PR (0.44) FUCA1AMY1ACA9CA12CA2
SCHEMBL24605082 0.81 M6PR (0.44) FUCA1AMY1ACA9CA12CA2
SCHEMBL12588436 0.81 M6PR (0.44) FUCA1AMY1ACA9CA12CA2
SCHEMBL3384820 0.81 M6PR (0.44) FUCA1AMY1ACA9CA12CA2
SCHEMBL2502348 0.81 M6PR (0.44) FUCA1AMY1ACA9CA12CA2
SCHEMBL1004728 0.81 M6PR (0.44) FUCA1AMY1ACA9CA12CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0796048-A1 MICRO-ORGANISMS, ENZYMES, AND THEIR USE BioTal Limited (GB) 1997-09-24 — — EP disclosed
WO-1996017525-A1 MICRO-ORGANISMS, ENZYMES, AND THEIR USE BIOTAL LTD. (GB) 1996-06-13 — — WO disclosed
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