SCHEMBL7756283

SCHEMBL7756283

Nc1ncnc2c1ncn2CCOC(CC(F)(F)F)(CC(F)(F)F)P(=O)(O)O

nearest known ligand 0.61

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SLC22A6 Q4U2R8 2/20 0.61
FGFR1 P11362 2/20 0.61
NSD3 Q9BZ95 6/20 0.54
NSD2 O96028 5/20 0.54
ADORA2A P29274 3/20 0.51
ADORA1 P30542 2/20 0.51
ABCB11 O95342 1/20 0.49
POLA1 P09884 1/20 0.49
POLG P54098 1/20 0.49
FAP Q12884 1/20 0.49
ENPP1 P22413 1/20 0.48
LMNA P02545 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
ADORA2B P29275 1/20 0.48
CA1 P00915 1/20 0.47
CA2 P00918 1/20 0.47
CA4 P22748 1/20 0.47
CA9 Q16790 1/20 0.47

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
SCHEMBL7757185 0.88 FGFR1 (0.58) SLC22A6FGFR1NSD3NSD2ADORA2A
SCHEMBL8089037 0.87 FDPS (0.51) SLC22A6FGFR1NSD3NSD2ABCB11
SCHEMBL3302562 0.86 FGFR1 (0.64) SLC22A6FGFR1NSD3NSD2ADORA2A
SCHEMBL7896377 0.86 CDK1 (0.48) SLC22A6FGFR1NSD3NSD2ABCB11
SCHEMBL6837988 0.81 HDAC1 (0.44)
SCHEMBL1933784 0.80 SLC22A6 (0.65) SLC22A6FGFR1NSD3NSD2ADORA2A
SCHEMBL8397115 0.80 FGFR1 (0.61) SLC22A6FGFR1NSD3NSD2ADORA2A
SCHEMBL7757187 0.80 NSD3 (0.56) SLC22A6FGFR1NSD3NSD2ADORA2A
SCHEMBL8092451 0.79 PNP (0.42) SLC22A6FGFR1POLA1POLG
SCHEMBL3293432 0.79 FGFR1 (0.47) SLC22A6FGFR1NSD3NSD2ADORA2A

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0632048-B1 Phosphonate-nucleotide ester derivatives MITSUBISHI CHEM CORP (JP) 2001-03-21 EP disclosed
US-6037335-A HAVE EXCELLENT ANTIVIRAL ACTIVITY AND ANTINEOPLASTIC ACTIVITY MITSUBISHI CHEMICAL CORPORATION (JP) 2000-03-14 US disclosed
EP-0632048-A1 Phosphonate-nucleotide ester derivatives Mitsubishi Chemical Corporation (JP) 1995-01-04 EP disclosed