SCHEMBL6757983

SCHEMBL6757983

CC1CC1Cn1cnc2c(N)ncnc21

nearest known ligand 0.60

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ADORA2A P29274 9/20 0.60
ADORA1 P30542 4/20 0.60
PI4KA P42356 3/20 0.60
PI4K2B Q8TCG2 3/20 0.60
PI4K2A Q9BTU6 3/20 0.60
PI4KB Q9UBF8 3/20 0.60
ADORA2B P29275 1/20 0.57
AHCY P23526 8/20 0.52
METTL3 Q86U44 1/20 0.49
METTL14 Q9HCE5 1/20 0.49

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
SCHEMBL6753737 0.86 ADORA2A (0.55) ADORA2AADORA1PI4KAPI4K2BPI4K2A
SCHEMBL9836332 0.83 AHCY (0.60) ADORA2AADORA1PI4KAPI4K2BPI4K2A
SCHEMBL19575549 0.83 AHCY (0.60) ADORA2AADORA1PI4KAPI4K2BPI4K2A
SCHEMBL10172077 0.81 ADORA2A (0.59) ADORA2AADORA1PI4KAPI4K2BPI4K2A
SCHEMBL7442359 0.78 ADORA2A (0.51) ADORA2AADORA1PI4KAPI4K2BPI4K2A
SCHEMBL23680075 0.78 AHCY (0.49) ADORA2AADORA1PI4KAPI4K2BPI4K2A
SCHEMBL10172072 0.77 ADORA2A (0.58) ADORA2AADORA1PI4KAPI4K2BPI4K2A
SCHEMBL10172012 0.77 ADORA2A (0.58) ADORA2AADORA1PI4KAPI4K2BPI4K2A
SCHEMBL19575550 0.77 PI4KA (0.50) ADORA2AADORA1PI4KAPI4K2BPI4K2A
SCHEMBL11222112 0.76 ADORA2A (0.80) ADORA2AADORA1PI4KAPI4K2BPI4K2A

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-1438052-A1 INHIBITORS OF HUMAN PHOSPHATIDYL−INOSITOL 3−KINASE DELTA ICOS CORPORATION (US) 2004-07-21 EP disclosed
WO-2003035075-A1 INHIBITORS OF HUMAN PHOSPHATIDYL-INOSITOL 3-KINASE DELTA ICOS CORPORATION (US) 2003-05-01 WO disclosed