SCHEMBL16016954

SCHEMBL16016954

COC1C(C(=O)O)CC(OC2C(O)C(CO)OC(OC3C(C(=O)O)CC(OC4C(O)C(CO)OC(C)C4NC(C)=O)C(O)C3O)C2NC(C)=O)C(O)C1O

nearest known ligand 0.43

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ CD69 Q07108 1/20 0.43
▸ MAPK1 P28482 2/20 0.39
▸ LGALS3 P17931 6/20 0.38
▸ LGALS8 O00214 3/20 0.37
▸ LGALS4 P56470 1/20 0.37
▸ ALDH1A1 P00352 1/20 0.37
▸ THRB P10828 1/20 0.37
▸ LGALS1 P09382 1/20 0.37
▸ LGALS7; LGALS7B P47929 1/20 0.37
▸ SELE P16581 2/20 0.37
▸ LGALS9 O00182 1/20 0.36
▸ CHIA Q9BZP6 1/20 0.36
▸ MDK P21741 1/20 0.35

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
SCHEMBL14113910 0.90 LGALS3 (0.43) CD69MAPK1LGALS3LGALS8LGALS4
SCHEMBL13994673 0.87 MAPK1 (0.41) CD69MAPK1LGALS3LGALS8LGALS4
SCHEMBL20230555 0.85 MDK (0.43) CD69LGALS3LGALS8LGALS4LGALS1
SCHEMBL20230554 0.84 MDK (0.43) CD69LGALS3LGALS8LGALS4MDK
SCHEMBL25964076 0.83 MAPK1 (0.41) CD69MAPK1LGALS3LGALS8LGALS4
SCHEMBL20230553 0.81 MDK (0.48) CD69MAPK1LGALS3LGALS8LGALS4
SCHEMBL13040929 0.81 MDK (0.48) CD69MAPK1LGALS3LGALS8LGALS4
SCHEMBL12552827 0.81 MDK (0.48) CD69MAPK1LGALS3LGALS8LGALS4
SCHEMBL14498180 0.81 MDK (0.46) CD69MAPK1LGALS3LGALS8LGALS4
SCHEMBL2602688 0.81 LGALS3 (0.49) CD69MAPK1LGALS3LGALS8LGALS4

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-20140256695-A1 INJECTABLE FILLER MIBA MEDICAL INC. 2014-09-11 — — US disclosed
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