SCHEMBL2904396

SCHEMBL2904396

[CH2]OC1(Cn2cnc3c(N)ncnc32)CC1C

nearest known ligand 0.52

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ADORA2A P29274 8/20 0.52
ADORA1 P30542 4/20 0.52
PI4KA P42356 3/20 0.52
PI4K2B Q8TCG2 3/20 0.52
PI4K2A Q9BTU6 3/20 0.52
PI4KB Q9UBF8 3/20 0.52
ADORA2B P29275 1/20 0.50
METTL3 Q86U44 1/20 0.47
METTL14 Q9HCE5 1/20 0.47
AHCY P23526 6/20 0.46
LMNA P02545 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
NSD3 Q9BZ95 1/20 0.44

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
SCHEMBL2904399 0.89 ADORA2A (0.54) ADORA2AADORA1PI4KAPI4K2BPI4K2A
SCHEMBL2906673 0.84 CCNE1 (0.53) ADORA2AADORA1PI4KAPI4K2BPI4K2A
SCHEMBL4279920 0.83 ADORA2A (0.48) ADORA2AADORA1PI4KAPI4K2BPI4K2A
SCHEMBL5665238 0.81 FGFR1 (0.56) ADORA2AADORA1PI4KAPI4K2BPI4K2A
SCHEMBL3293448 0.81 FGFR1 (0.56) ADORA2AADORA1PI4KAPI4K2BPI4K2A
SCHEMBL4279921 0.80 CYP3A4 (0.47) ADORA2AADORA1PI4KAPI4K2BPI4K2A
SCHEMBL2906656 0.79 ADORA2A (0.55) ADORA2AADORA1PI4KAPI4K2BPI4K2A
SCHEMBL13328630 0.78 CYP3A4 (0.48) ADORA2AADORA1PI4KAPI4K2BPI4K2A
SCHEMBL2943371 0.77 CCNE1 (0.39)
SCHEMBL2912070 0.77 CYP3A4 (0.49) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1358198-B1 NOVEL ACYCLIC NUCLEOSIDE PHOSPHONATE DERIVATIVES, SALTS THEREOF AND PROCESS FOR THE PREPARATION OF THE SAME LG LIFE SCIENCES LTD (KR) 2010-08-25 EP claimed