SCHEMBL17021012

SCHEMBL17021012

COC1(C(=O)O)CC(O)C(NC(=O)CN)C(C(O)C(O)CO)O1

nearest known ligand 0.59

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ NANP Q8TBE9 2/20 0.59
▸ CD22 P20273 10/20 0.44
▸ MAG P20916 3/20 0.44
▸ SELL P14151 1/20 0.42
▸ SELP P16109 1/20 0.42
▸ L3MBTL1 Q9Y468 1/20 0.42

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
SCHEMBL15321632 0.91 NANP (0.61) NANPCD22MAG
SCHEMBL23969097 0.90 NANP (0.48) NANPCD22MAGSELLSELP
SCHEMBL17722651 0.88 NANP (0.63) NANPCD22MAGSELLSELP
SCHEMBL17000127 0.88 NANP (0.63) NANPCD22MAGSELLSELP
SCHEMBL8489507 0.88 NANP (0.74) NANPCD22MAGSELLSELP
SCHEMBL13125452 0.88 NANP (0.74) NANPCD22MAGSELLSELP
SCHEMBL2742889 0.88 NANP (0.74) NANPCD22MAGSELLSELP
SCHEMBL28161285 0.88 NANP (0.74) NANPCD22MAGSELLSELP
SCHEMBL7066109 0.88 NANP (0.74) NANPCD22MAGSELLSELP
SCHEMBL15976325 0.88 NANP (0.74) NANPCD22MAGSELLSELP

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
WO-2015121387-A1 COAGULATION FACTOR IX CONJUGATES NOVO NORDISK HEALTH CARE AG (CH) 2015-08-20 — — WO disclosed
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