SCHEMBL10697042

SCHEMBL10697042

Nc1ncnc2c1ncn2[C@H]1CC[C@@H](COCc2ccccc2)O1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BCHE P06276 1/20 0.53
AHCY P23526 3/20 0.51
PI4KA P42356 3/20 0.47
PI4K2B Q8TCG2 3/20 0.47
PI4K2A Q9BTU6 3/20 0.47
PI4KB Q9UBF8 3/20 0.47
TP53 P04637 1/20 0.47
CYP2C9 P11712 1/20 0.47
NFKB1 P19838 1/20 0.47
MAPK1 P28482 1/20 0.47
HSD17B10 Q99714 1/20 0.47
MEN1 O00255 1/20 0.47
ALDH1A1 P00352 1/20 0.47
APEX1 P27695 1/20 0.47
BLM P54132 1/20 0.47
KMT2A Q03164 1/20 0.47
ADCY1 Q08828 1/20 0.47
DOT1L Q8TEK3 1/20 0.46
ADA P00813 1/20 0.46
ADORA2A P29274 4/20 0.45

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
SCHEMBL24201290 0.94 BCHE (0.51) BCHEAHCYPI4KAPI4K2BPI4K2A
SCHEMBL9813105 0.87 AHCY (0.57) BCHEAHCYPI4KAPI4K2BPI4K2A
SCHEMBL17804408 0.84 BCHE (0.53) BCHEAHCYPI4KAPI4K2BPI4K2A
SCHEMBL7070026 0.83 BCHE (0.53) BCHEAHCYPI4KAPI4K2BPI4K2A
SCHEMBL10427715 0.82 BCHE (0.55) BCHEAHCYPI4KAPI4K2BPI4K2A
SCHEMBL24181819 0.82 ADA (0.54) BCHEAHCYPI4KAPI4K2BPI4K2A
SCHEMBL11402107 0.82 AHCY (0.58) BCHEAHCYDOT1LHSPA5PDE2A
SCHEMBL10431698 0.82 AHCY (0.49) AHCYTP53CYP2C9NFKB1MAPK1
SCHEMBL23516968 0.82 BCHE (0.57) BCHEAHCYPI4KAPI4K2BPI4K2A
SCHEMBL20624631 0.82 BCHE (0.57) BCHEAHCYPI4KAPI4K2BPI4K2A

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-0285884-A2 Process to produce 2', 3'-Dideoxynucleosides Bristol-Myers Squibb Company (US) 1988-10-12 EP disclosed