SCHEMBL8970900

SCHEMBL8970900

COc1ccccc1C(c1ccccc1)(c1ccccc1OC)[C@@]1(n2cnc3c(O)ncnc32)O[C@H](CO)[C@@H](O)[C@H]1O

nearest known ligand 0.42

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
SLC29A1 Q99808 2/20 0.37
ADORA3 P0DMS8 3/20 0.35
ADORA2A P29274 3/20 0.35
ADORA1 P30542 3/20 0.35
ADORA2B P29275 1/20 0.35
NFKB1 P19838 1/20 0.34
THPO P40225 1/20 0.34
TSHR P16473 1/20 0.34

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
SCHEMBL10381790 0.91 ADORA1 (0.43) SLC29A1ADORA3ADORA2AADORA1ADORA2B
SCHEMBL10890138 0.81 ADORA3 (0.43) ADORA3ADORA2AADORA1ADORA2BNFKB1
SCHEMBL1068569 0.80 ADORA1 (0.44) SLC29A1ADORA3ADORA2AADORA1ADORA2B
SCHEMBL9705275 0.79 ADORA3 (0.46) SLC29A1ADORA3ADORA2AADORA1ADORA2B
SCHEMBL5859569 0.78 PI4KA (0.43) SLC29A1ADORA3ADORA2AADORA1ADORA2B
SCHEMBL9752462 0.77 LMNA (0.38) SLC29A1ADORA2AADORA2B
SCHEMBL674400 0.74 ADORA1 (0.48) SLC29A1ADORA3ADORA2AADORA1ADORA2B
SCHEMBL6852710 0.74 ADORA1 (0.48) SLC29A1ADORA3ADORA2AADORA1ADORA2B
SCHEMBL5954785 0.74 ADORA2A (0.31) ADORA2AADORA2B
SCHEMBL6756343 0.73 RNASE1 (0.36)

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
US-5525719-A N-protected-2'-O-methyl-and N-protected-3'-O-methyl-ribonucleosides and their phosphoramidite derivatives CHEMGENES CORPORATION (US) 1996-06-11 US disclosed