SCHEMBL19731922

SCHEMBL19731922

COC1OC(C(=O)O)C(O)C(O)C1OS(=O)(=O)O

nearest known ligand 0.47

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
F10 P00742 5/20 0.47
CXCL10 P02778 1/20 0.45
CXCL8 P10145 1/20 0.45
CCL2 P13500 1/20 0.45
CCL5 P13501 1/20 0.45
CXCL12 P48061 1/20 0.45
SERPINC1 P01008 1/20 0.43
FGF1 P05230 2/20 0.37
BDNF P23560 3/20 0.35
PTN P21246 2/20 0.35
MDK P21741 2/20 0.35
M6PR P20645 1/20 0.33
FGF2 P09038 1/20 0.33
AKT1 P31749 1/20 0.32
IDUA P35475 1/20 0.32
HPSE Q9Y251 2/20 0.32
LGALS8 O00214 1/20 0.31

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
SCHEMBL14118445 1.00 F10 (0.47) F10CXCL10CXCL8CCL2CCL5
SCHEMBL15942927 0.91 F10 (0.52) F10CXCL10CXCL8CCL2CCL5
SCHEMBL10085262 0.91 F10 (0.52) F10CXCL10CXCL8CCL2CCL5
SCHEMBL15905314 0.81 CXCL10 (0.40) F10CXCL10CXCL8CCL2CCL5
SCHEMBL16728908 0.81 CXCL10 (0.39) F10CXCL10CXCL8CCL2CCL5
SCHEMBL782333 0.80 CXCL10 (0.40) F10CXCL10CXCL8CCL2CCL5
SCHEMBL28460941 0.80 CXCL10 (0.40) F10CXCL10CXCL8CCL2CCL5
SCHEMBL21840769 0.80 CXCL10 (0.40) F10CXCL10CXCL8CCL2CCL5
SCHEMBL22712706 0.80 CXCL10 (0.40) F10CXCL10CXCL8CCL2CCL5
SCHEMBL17847369 0.80 CXCL10 (0.40) F10CXCL10CXCL8CCL2CCL5

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
US-20170362632-A1 ENZYMATIC ACTIVITY ASSAYS FOR I2S SHIRE HUMAN GENETIC THERAPIES, INC. 2017-12-21 US disclosed