SCHEMBL15087708

SCHEMBL15087708

CC(=O)NC1[C@H]([C@H](O)[C@H](O)CNC(=O)c2ccc(-c3ccccc3)cc2)O[C@@](OCCCSCCNC(=O)CCCCC(=O)NCCSCCCO[C@]2(C(=O)O)C[C@H](O)[C@@H](NC(C)=O)[C@H]([C@H](O)[C@H](O)CNC(=O)c3ccc(-c4ccccc4)cc3)O2)(C(=O)O)C[C@@H]1O

nearest known ligand 0.89

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
CD22 P20273 7/20 0.89

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
SCHEMBL16373024 1.00 CD22 (0.89) CD22
SCHEMBL16373015 0.98 CD22 (0.85) CD22
SCHEMBL16373016 0.96 CD22 (0.83) CD22
SCHEMBL16373018 0.95 CD22 (0.81) CD22
SCHEMBL16373029 0.95 CD22 (0.81) CD22
SCHEMBL16373010 0.95 CD22 (0.88) CD22
SCHEMBL15087772 0.95 CD22 (0.88) CD22
SCHEMBL16373153 0.95 CD22 (0.81) CD22
SCHEMBL17538456 0.95 CD22 (0.81) CD22
SCHEMBL16373044 0.95 CD22 (0.85) CD22

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-2610263-A1 Sialic acid dimers Brossmer, Reinhard (DE) 2013-07-03 EP disclosed