SCHEMBL3453941

SCHEMBL3453941

CCCCc1nc2nc([SiH](C)C)nc(N)c2[nH]1

nearest known ligand 0.54

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PI4KA P42356 1/20 0.54
PI4K2B Q8TCG2 1/20 0.54
PI4K2A Q9BTU6 1/20 0.54
PI4KB Q9UBF8 1/20 0.54
ADORA3 P0DMS8 5/20 0.38
ALDH1A1 P00352 1/20 0.36
MAPK1 P28482 1/20 0.36
ADORA2A P29274 4/20 0.33
ADORA1 P30542 3/20 0.33
PARP1 P09874 1/20 0.33
ADORA2B P29275 2/20 0.32
POLA1 P09884 1/20 0.32

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
SCHEMBL2576515 0.76 PI4KA (0.61) PI4KAPI4K2BPI4K2API4KBADORA3
SCHEMBL9668602 0.74 PI4KA (0.91) PI4KAPI4K2BPI4K2API4KBALDH1A1
SCHEMBL1377645 0.72 PI4KA (0.49) PI4KAPI4K2BPI4K2API4KBADORA3
SCHEMBL2045845 0.72 PI4KA (0.49) PI4KAPI4K2BPI4K2API4KBADORA3
SCHEMBL6272728 0.71 PNP (0.58) PI4KAPI4K2BPI4K2API4KBALDH1A1
SCHEMBL28097214 0.70 PI4KA (0.54) PI4KAPI4K2BPI4K2API4KBADORA3
SCHEMBL4551802 0.70 PI4KA (1.00) PI4KAPI4K2BPI4K2API4KBALDH1A1
SCHEMBL28476418 0.68 PI4KA (0.44) PI4KAPI4K2BPI4K2API4KBADORA3
SCHEMBL8522269 0.67 PNP (0.56) PI4KAPI4K2BPI4K2API4KBALDH1A1
SCHEMBL27867155 0.66 PI4KA (0.49) PI4KAPI4K2BPI4K2API4KBALDH1A1

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-2217612-A1 PREPARATION OF NUCLEOTIDE OLIGOMER Samchully Pharm. Co., Ltd. (KR) 2010-08-18 EP disclosed
WO-2009064115-A1 PREPARATION OF NUCLEOTIDE OLIGOMER SAMCHULLY PHARM. CO., LTD. (KR) 2009-05-22 WO disclosed