SCHEMBL9687934

SCHEMBL9687934

Oc1ncnc2c1ncn2[C@H]1C=C[C@@H](COCc2ccccc2)O1

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SLC29A1 Q99808 3/20 0.43
AHCY P23526 2/20 0.41
BCHE P06276 1/20 0.40
PDE2A O00408 2/20 0.39
P2RY12 Q9H244 3/20 0.38
HSPA5 P11021 1/20 0.37
ADORA3 P0DMS8 3/20 0.37
TP53 P04637 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
STAT6 P42226 1/20 0.37
DNPH1 O43598 1/20 0.36
DOT1L Q8TEK3 1/20 0.36
DAPK1 P53355 1/20 0.36
ADORA2A P29274 2/20 0.36
P2RY2 P41231 1/20 0.36
P2RY1 P47900 1/20 0.36

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
SCHEMBL9689226 0.84 ADORA3 (0.53) SLC29A1ADORA3TP53TDP1DNPH1
SCHEMBL9689038 0.79 BCHE (0.39) SLC29A1AHCYBCHEP2RY12ADORA3
SCHEMBL5493631 0.79 EHMT1 (0.39) SLC29A1AHCYBCHEADORA3ADORA2A
SCHEMBL1140717 0.78 SLC29A1 (0.64) SLC29A1AHCYPDE2AHSPA5ADORA3
SCHEMBL1140703 0.78 EGFR (0.41) SLC29A1BCHEADORA3TP53STAT6
SCHEMBL13238881 0.78 EGFR (0.41) SLC29A1BCHEADORA3TP53STAT6
SCHEMBL2045673 0.78 EGFR (0.41) SLC29A1BCHEADORA3TP53STAT6
SCHEMBL9851725 0.78 SLC29A1 (0.48) SLC29A1AHCYBCHEPDE2AADORA3
SCHEMBL9851716 0.78 SLC29A1 (0.48) SLC29A1AHCYBCHEPDE2AADORA3
SCHEMBL2955999 0.78 BCHE (0.42) AHCYBCHEADORA3TP53TDP1

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-0493602-A1 PROCESS FOR PRODUCING 2',3'-DIDEOXY-2',3'-DIDEHYDRONUCLEOSIDE YUKI GOSEI KOGYO CO., LTD. (JP) 1992-07-08 EP disclosed