SCHEMBL7055376

SCHEMBL7055376

O=c1[nH]c(=O)n(CCC2CC2)c2nc(O)[nH]c12

nearest known ligand 0.48

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ADORA1 P30542 2/20 0.48
ADORA2A P29274 6/20 0.47
ADORA2B P29275 5/20 0.47
TLR7 Q9NYK1 7/20 0.40
HPGD P15428 2/20 0.36
PDE4A P27815 2/20 0.36
PDE4B Q07343 2/20 0.36
PDE4C Q08493 2/20 0.36
PDE4D Q08499 2/20 0.36
ADORA3 P0DMS8 1/20 0.36
BLM P54132 1/20 0.36
PDE3A Q14432 1/20 0.36
HSD17B10 Q99714 1/20 0.36
MTOR P42345 1/20 0.36

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
SCHEMBL3185628 0.83 ADORA1 (0.48) ADORA1ADORA2AADORA2BTLR7HPGD
SCHEMBL3181198 0.78 ADORA1 (0.52) ADORA1ADORA2AADORA2BTLR7HPGD
SCHEMBL3179786 0.78 ADORA1 (0.49) ADORA1ADORA2AADORA2BTLR7HPGD
SCHEMBL3175429 0.77 ADORA2A (0.53) ADORA1ADORA2AADORA2BTLR7HPGD
SCHEMBL3176858 0.76 ADORA1 (0.46) ADORA1ADORA2AADORA2BTLR7PDE4A
SCHEMBL3188553 0.69 PDE5A (0.45) ADORA1ADORA2AADORA2BTLR7PDE4A
SCHEMBL7345938 0.69 PDE5A (0.66) ADORA1ADORA2AADORA2BTLR7PDE4A
SCHEMBL13451946 0.68 HPGD (0.47) TLR7HPGDMTOR
SCHEMBL3179415 0.68 ALDH1A1 (0.46) HPGDHSD17B10
SCHEMBL5227560 0.67 ADORA1 (0.90) ADORA1ADORA2AADORA2BADORA3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1305328-A2 MATERIALS AND METHODS FOR BINDING NUCLEIC ACIDS TO SURFACES Lyles, Mark B. (US) 2003-05-02 EP claimed
WO-2002008237-A2 MATERIALS AND METHODS FOR BINDING NUCLEIC ACIDS TO SURFACES LYLES MARK B (US) 2002-01-31 WO claimed