SCHEMBL17636458

SCHEMBL17636458

CO[C@@H]1C(C(=O)O)OC(C)C(O)C1O

nearest known ligand 0.39

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ SUCNR1 Q9BXA5 1/20 0.36
▸ CA9 Q16790 2/20 0.33
▸ CA12 O43570 1/20 0.33
▸ CA2 P00918 1/20 0.33
▸ M6PR P20645 1/20 0.32
▸ SELP P16109 2/20 0.31
▸ SELL P14151 1/20 0.31
▸ FUCA1 P04066 1/20 0.30
▸ IDUA P35475 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
SCHEMBL19774832 1.00 SUCNR1 (0.36) SUCNR1CA9CA12CA2M6PR
SCHEMBL25788571 1.00 SUCNR1 (0.36) SUCNR1CA9CA12CA2M6PR
SCHEMBL18271877 1.00 SUCNR1 (0.36) SUCNR1CA9CA12CA2M6PR
SCHEMBL26715975 1.00 SUCNR1 (0.36) SUCNR1CA9CA12CA2M6PR
SCHEMBL11915786 1.00 SUCNR1 (0.36) SUCNR1CA9CA12CA2M6PR
SCHEMBL16392508 1.00 SUCNR1 (0.36) SUCNR1CA9CA12CA2M6PR
SCHEMBL26715981 1.00 SUCNR1 (0.36) SUCNR1CA9CA12CA2M6PR
SCHEMBL18269757 1.00 SUCNR1 (0.36) SUCNR1CA9CA12CA2M6PR
SCHEMBL19488918 0.89 F10 (0.39) M6PR
SCHEMBL18969723 0.89 F10 (0.39) M6PR

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-3000820-A1 Synthetic vaccines against Streptococcus pneumoniae serotype 8 Max-Planck-Gesellschaft zur Förderung der Wissenschaften e.V. (DE) 2016-03-30 — — EP disclosed
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