SCHEMBL2911275

SCHEMBL2911275

CP(=O)(O)OOC1(Cn2cnc3c(N)ncnc32)CC1(CC(F)(F)F)CC(F)(F)F

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 4/20 0.43
SLC22A6 Q4U2R8 2/20 0.43
FGFR1 P11362 2/20 0.43
ADORA2A P29274 4/20 0.42
ADORA1 P30542 4/20 0.42
PI4KA P42356 2/20 0.42
PI4K2B Q8TCG2 2/20 0.42
PI4K2A Q9BTU6 2/20 0.42
PI4KB Q9UBF8 2/20 0.42
ENPP1 P22413 1/20 0.40
ADCY5 O95622 2/20 0.39
ADORA2B P29275 1/20 0.38
AHCY P23526 1/20 0.38
METTL3 Q86U44 1/20 0.38
METTL14 Q9HCE5 1/20 0.38
NSD2 O96028 1/20 0.38
NSD3 Q9BZ95 1/20 0.38
ABCB11 O95342 1/20 0.38
POLA1 P09884 1/20 0.38
POLG P54098 1/20 0.38

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
SCHEMBL2906000 0.82 CYP3A4 (0.50) CYP3A4SLC22A6FGFR1ADORA2AADORA1
SCHEMBL2904804 0.81 KDM4E (0.38)
SCHEMBL4279921 0.77 CYP3A4 (0.47) CYP3A4SLC22A6FGFR1ADORA2AADORA1
SCHEMBL4267091 0.76 ADORA2A (0.50) ADORA2AADORA1PI4KAPI4K2BPI4K2A
SCHEMBL2913580 0.72 CYP3A4 (0.50) CYP3A4SLC22A6FGFR1ADORA2AADORA1
SCHEMBL3290251 0.72 FGFR1 (0.60) CYP3A4SLC22A6FGFR1ADORA2AADORA1
SCHEMBL28797058 0.70 SLC22A6 (0.67) CYP3A4SLC22A6FGFR1ADORA2AADORA1
SCHEMBL3293432 0.70 FGFR1 (0.47) CYP3A4SLC22A6FGFR1ADORA2AADORA1
SCHEMBL4558842 0.69 CYP3A4 (0.70) CYP3A4ADORA2AADORA1AHCYFAP
SCHEMBL8395927 0.69 CYP3A4 (0.70) CYP3A4ADORA2AADORA1AHCYFAP

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