SCHEMBL9856198

SCHEMBL9856198

Cc1ccc(S(=O)(=O)O[C@H]2C[C@H](n3cnc4c(N)ncnc43)O[C@@H]2CO)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ADA P00813 1/20 0.47
▸ ENPP1 P22413 2/20 0.47
▸ P2RY1 P47900 1/20 0.47
▸ ADORA3 P0DMS8 3/20 0.46
▸ ADORA1 P30542 2/20 0.46
▸ ADORA2A P29274 2/20 0.46
▸ POLB P06746 2/20 0.46
▸ DPP4 P27487 1/20 0.46
▸ MEN1 O00255 1/20 0.46
▸ SLC28A1 O00337 1/20 0.46
▸ MAP3K7 O43318 1/20 0.46
▸ SLC28A2 O43868 1/20 0.46
▸ GAPDH P04406 1/20 0.46
▸ MAPK1 P28482 1/20 0.46
▸ ADORA2B P29275 1/20 0.46
▸ STAT6 P42226 1/20 0.46
▸ PI4KA P42356 1/20 0.46
▸ KMT2A Q03164 1/20 0.46
▸ SMN1; SMN2 Q16637 1/20 0.46
▸ PI4K2B Q8TCG2 1/20 0.46

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
SCHEMBL11430238 0.85 ADA (0.53) ADAENPP1P2RY1ADORA3ADORA1
SCHEMBL766552 0.83 ENPP1 (0.60) ENPP1P2RY1POLB
SCHEMBL16174396 0.83 ENPP1 (0.60) ENPP1P2RY1POLB
SCHEMBL2788058 0.83 ENPP1 (0.60) ENPP1P2RY1POLB
SCHEMBL15832423 0.81 ADA (0.57) ADAENPP1P2RY1ADORA3ADORA1
SCHEMBL16360128 0.81 ADA (0.57) ADAENPP1P2RY1ADORA3ADORA1
SCHEMBL10432419 0.81 ADA (0.57) ADAENPP1P2RY1ADORA3ADORA1
SCHEMBL9194199 0.81 ADORA1 (0.63) ADORA3ADORA1ADORA2APOLBDPP4
SCHEMBL9194212 0.81 ADORA1 (0.63) ADORA3ADORA1ADORA2APOLBDPP4
SCHEMBL10446527 0.80 ADA (0.58) ADAENPP1P2RY1ADORA3ADORA1

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-0409227-A2 Pyrimidine nucleosides, their preparation and pharmaceutical preparations MATTHES, Eckart, Dr. (DE) 1991-01-23 — — EP disclosed
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