SCHEMBL7985284

SCHEMBL7985284

CCCCn1cnc2nc(-c3cc(C)c(OCc4ccccc4)c(C)c3)nc(O)c21

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TLR4 O00206 1/20 0.35
TLR3 O15455 1/20 0.35
TLR5 O60602 1/20 0.35
TLR2 O60603 1/20 0.35
CAMK2B Q13554 1/20 0.35
CAMK2G Q13555 1/20 0.35
CAMK2D Q13557 1/20 0.35
CAMK1 Q14012 1/20 0.35
CAMK4 Q16566 1/20 0.35
PNCK Q6P2M8 1/20 0.35
CAMK1D Q8IU85 1/20 0.35
CAMK1G Q96NX5 1/20 0.35
TLR9 Q9NR96 1/20 0.35
TLR8 Q9NR97 1/20 0.35
TLR7 Q9NYK1 1/20 0.35
CAMK2A Q9UQM7 1/20 0.35
HPGD P15428 2/20 0.33
LMNA P02545 2/20 0.33
CNOT7 Q9UIV1 4/20 0.33
NPC1 O15118 1/20 0.33

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
SCHEMBL7985784 0.82 LMNA (0.40) HPGDLMNAALDH1A1GAAPOLB
SCHEMBL7988251 0.82 NR1H3 (0.43) TLR8HPGDCNOT7NPC1ALDH1A1
SCHEMBL7985282 0.79 ALDH1A1 (0.41) HPGDLMNAALDH1A1NPSR1POLB
SCHEMBL7985379 0.79 TLR8 (0.44) TLR8HPGDCNOT7NPC1ALDH1A1
SCHEMBL7984968 0.78 GAA (0.40) TLR7HPGDLMNAALDH1A1NR1H3
SCHEMBL7974065 0.78 TLR8 (0.43) TLR8HPGDCNOT7NPC1ALDH1A1
SCHEMBL7984888 0.76 HPGD (0.41) HPGDLMNACNOT7ALDH1A1GAA
SCHEMBL7987443 0.75 GAA (0.37) TLR7HPGDLMNANPC1ALDH1A1
SCHEMBL7985000 0.75 ADORA2A (0.40) TLR9NR1H3
SCHEMBL7985071 0.75 BCL2L2 (0.39) HPGDLMNAALDH1A1GAA

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
US-6310070-B1 FOR TREATING NEPHRITIS, IMPROVING PROTEINURIA DUE TO GLOMERULONEPHRITIS AND PREVENTING AGGRAVATION OF NEPHRITIS JAPAN ENERGY CORPORATION (JP) 2001-10-30 US disclosed
EP-0999211-A1 NOVEL PURINE DERIVATIVES AND MEDICINAL USE THEREOF JAPAN ENERGY CORPORATION (JP) 2000-05-10 EP disclosed