SCHEMBL18672103

SCHEMBL18672103

CCOc1nc(N)nc2c1ncn2[C@@H]1O[C@](F)(CO)C(F)[C@@]1(C)O

nearest known ligand 0.50

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ ADORA2A P29274 6/20 0.40
▸ ADA P00813 1/20 0.36
▸ SLC29A1 Q99808 5/20 0.35
▸ ADORA3 P0DMS8 4/20 0.34
▸ ADORA1 P30542 3/20 0.34
▸ ADORA2B P29275 2/20 0.34
▸ CYP2C19 P33261 1/20 0.33
▸ ALOX15 P16050 1/20 0.33
▸ HSP90B1 P14625 1/20 0.32
▸ AHCY P23526 1/20 0.31

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
SCHEMBL16368132 1.00 ADORA2A (0.40) ADORA2AADASLC29A1ADORA3ADORA1
SCHEMBL16374113 1.00 ADORA2A (0.40) ADORA2AADASLC29A1ADORA3ADORA1
SCHEMBL22474872 0.91 ADORA2A (0.37) ADORA2AADASLC29A1ADORA3ADORA1
SCHEMBL20754490 0.90 ADORA2A (0.40) ADORA2AADASLC29A1ADORA3ADORA1
SCHEMBL17357535 0.89 ADORA2A (0.35) ADORA2AADAADORA3ADORA1ADORA2B
SCHEMBL16647605 0.89 ADORA2A (0.40) ADORA2AADASLC29A1ADORA3ADORA1
SCHEMBL18671933 0.87 ADORA2A (0.38) ADORA2AADASLC29A1ADORA3ADORA1
SCHEMBL16644510 0.87 ADORA2A (0.33) ADORA2AADASLC29A1ADORA3ADORA1
SCHEMBL16647595 0.85 ADORA2A (0.39) ADORA2AADASLC29A1ADORA3ADORA1
SCHEMBL31228203 0.84 ADORA2A (0.39) ADORA2AADASLC29A1ADORA3ADORA1

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-9603863-B2 Substituted nucleosides, nucleotides and analogs thereof ALIOS BIOPHARMA, INC. (US) 2017-03-28 — — US disclosed
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