SCHEMBL8712262

SCHEMBL8712262

CC(=O)O[C@]1(C(C)=O)[C@H](O)[C@@H](CON)O[C@@]1(C(C)=O)n1ccc(N)nc1=O

nearest known ligand 0.39

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
POLA1 P09884 1/20 0.38
PDE4D Q08499 1/20 0.34
PDE3A Q14432 1/20 0.34
SLC29A1 Q99808 1/20 0.34
LMNA P02545 1/20 0.33
THRB P10828 1/20 0.33
MTOR P42345 1/20 0.33
MDM2 Q00987 1/20 0.33
NCOA1 Q15788 1/20 0.33
NCOA3 Q9Y6Q9 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
TSHR P16473 1/20 0.30
GLA P06280 1/20 0.30
POLB P06746 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
SCHEMBL381848 0.90 PDE3A (0.41) POLA1PDE4DPDE3ASLC29A1LMNA
SCHEMBL8716120 0.76 POLA1 (0.40) POLA1PDE4DPDE3ASLC29A1LMNA
SCHEMBL12813023 0.76 DNMT1 (0.41) LMNAMTOR
SCHEMBL6534202 0.74 PDE3A (0.45) POLA1PDE4DPDE3ASLC29A1LMNA
SCHEMBL27321202 0.73 PDE3A (0.44) POLA1PDE4DPDE3ASLC29A1LMNA
SCHEMBL29414447 0.73 PDE3A (0.42) POLA1PDE4DPDE3ASLC29A1LMNA
SCHEMBL31189348 0.72 PDE3A (0.48) POLA1PDE4DPDE3ASLC29A1LMNA
SCHEMBL6060293 0.71 PDE3A (0.35) POLA1PDE4DPDE3ASLC29A1LMNA
SCHEMBL11664470 0.70 LMNA (0.46) POLA1PDE4DPDE3ASLC29A1LMNA
SCHEMBL60518 0.69 SLC28A1 (0.39) SLC29A1LMNA

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0698610-B1 PROCESS FOR PRODUCING SIALIC ACID DERIVATIVE AND NOVEL SIALIC ACID DERIVATIVE JAPAN TOBACCO INC (JP) 1998-08-12 EP disclosed
US-5621086-A Sialic acid derivative and method of manufacturing it JAPAN TOBACCO INC. (JP) 1997-04-15 US disclosed
EP-0698610-A1 PROCESS FOR PRODUCING SIALIC ACID DERIVATIVE AND NOVEL SIALIC ACID DERIVATIVE Japan Tobacco Inc. (JP) 1996-02-28 EP disclosed