SCHEMBL12875233

SCHEMBL12875233

COP(=O)(O)COCCn1cnc2c(N)ncnc21

nearest known ligand 0.78

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
FGFR1 P11362 3/20 0.78
SLC22A6 Q4U2R8 2/20 0.78
ABCB11 O95342 1/20 0.61
POLA1 P09884 1/20 0.61
POLG P54098 1/20 0.61
FAP Q12884 1/20 0.61
NSD3 Q9BZ95 2/20 0.56
ENPP1 P22413 1/20 0.55
CYP3A4 P08684 2/20 0.55
ADORA2A P29274 4/20 0.53
ADORA1 P30542 2/20 0.53
ADORA2B P29275 1/20 0.53
LMNA P02545 2/20 0.53
SMN1; SMN2 Q16637 2/20 0.53
HPGD P15428 1/20 0.51
ADCY5 O95622 1/20 0.51
NSD2 O96028 1/20 0.50
CYP2D6 P10635 1/20 0.50

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
SCHEMBL3301357 0.88 FGFR1 (0.78) FGFR1SLC22A6ABCB11POLA1POLG
SCHEMBL13805638 0.88 FGFR1 (0.78) FGFR1SLC22A6ABCB11POLA1POLG
SCHEMBL28797052 0.88 FGFR1 (0.74) FGFR1SLC22A6ABCB11POLA1POLG
SCHEMBL12393103 0.88 FGFR1 (0.82) FGFR1SLC22A6ABCB11POLA1POLG
SCHEMBL173078 0.88 FGFR1 (0.80) FGFR1SLC22A6ABCB11POLA1POLG
Adefovir SCHEMBL49373 0.88 FGFR1 (1.00) FGFR1SLC22A6ABCB11POLA1POLG
Adefovir SCHEMBL29365535 0.88 FGFR1 (1.00) FGFR1SLC22A6ABCB11POLA1POLG
SCHEMBL29258953 0.87 FGFR1 (0.77) FGFR1SLC22A6ABCB11POLA1POLG
Adefovir SCHEMBL3639260 0.87 FGFR1 (0.97) FGFR1SLC22A6ABCB11POLA1POLG
Adefovir SCHEMBL439995 0.87 FGFR1 (0.97) FGFR1SLC22A6ABCB11POLA1POLG

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
WO-2011016044-A1 NOVEL POLYMORPHS OF ADEFOVIR DIPIVOXIL HETERO RESEARCH FOUNDATION (IN) 2011-02-10 WO disclosed