SCHEMBL20056910

SCHEMBL20056910

CCOc1nc(N)nc2c1ncn2C1OC(COP(O)(=S)OC(C)C)CC1C

nearest known ligand 0.41

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ NT5E P21589 2/20 0.38
▸ P2RY1 P47900 1/20 0.38
▸ P2RY11 Q96G91 1/20 0.38
▸ SLC29A1 Q99808 3/20 0.36
▸ FHIT P49789 1/20 0.36
▸ HINT1 P49773 1/20 0.35
▸ ADORA2A P29274 2/20 0.35
▸ ADORA2B P29275 2/20 0.35
▸ ADORA3 P0DMS8 2/20 0.35
▸ ADORA1 P30542 2/20 0.35

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
SCHEMBL23010227 0.93 NT5E (0.38) NT5EP2RY1P2RY11SLC29A1FHIT
SCHEMBL23010941 0.92 NT5E (0.39) NT5EP2RY1P2RY11SLC29A1HINT1
SCHEMBL19187036 0.91 NT5E (0.41) NT5EP2RY1P2RY11SLC29A1
SCHEMBL19827632 0.88 CA5A (0.44) NT5EP2RY1P2RY11ADORA1
SCHEMBL20056907 0.85 NT5E (0.40) NT5EP2RY1P2RY11HINT1ADORA2A
SCHEMBL16024938 0.84 P2RY1 (0.48) P2RY1P2RY11
SCHEMBL19186747 0.84 NT5E (0.41) NT5EP2RY1P2RY11
SCHEMBL10266182 0.83 ADORA2A (0.45) SLC29A1ADORA2AADORA2BADORA3ADORA1
SCHEMBL23584291 0.83 ADORA2A (0.45) SLC29A1ADORA2AADORA2BADORA3ADORA1
SCHEMBL13469562 0.83 ADORA2A (0.45) SLC29A1ADORA2AADORA2BADORA3ADORA1

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-2655392-B1 CYCLIC NUCLEOTIDE ANALOGS ALIOS BIOPHARMA INC (US) 2018-04-18 — — EP disclosed
Send feedback