SCHEMBL9569753

SCHEMBL9569753

Nc1ncnc2c1ncn2CC[C@H](/C=C/P(=O)(O)O)CO

nearest known ligand 0.54

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ADORA2A P29274 6/20 0.54
ADORA1 P30542 2/20 0.54
FGFR1 P11362 1/20 0.53
SLC22A6 Q4U2R8 1/20 0.53
AHCY P23526 8/20 0.51
ADORA2B P29275 1/20 0.48
CYP3A4 P08684 1/20 0.47
ADCY5 O95622 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
SCHEMBL9569758 1.00 ADORA2A (0.54) ADORA2AADORA1FGFR1SLC22A6AHCY
SCHEMBL9569750 1.00 ADORA2A (0.54) ADORA2AADORA1FGFR1SLC22A6AHCY
SCHEMBL9294953 0.89 AHCY (0.58) ADORA2AADORA1FGFR1SLC22A6AHCY
SCHEMBL9294967 0.89 AHCY (0.58) ADORA2AADORA1FGFR1SLC22A6AHCY
SCHEMBL9569748 0.86 FGFR1 (0.55) ADORA2AADORA1FGFR1SLC22A6AHCY
SCHEMBL9569751 0.86 FGFR1 (0.55) ADORA2AADORA1FGFR1SLC22A6AHCY
SCHEMBL9569755 0.86 FGFR1 (0.55) ADORA2AADORA1FGFR1SLC22A6AHCY
SCHEMBL9569546 0.86 ADORA2A (0.48) ADORA2AADORA1FGFR1SLC22A6AHCY
SCHEMBL9569538 0.86 ADORA2A (0.48) ADORA2AADORA1FGFR1SLC22A6AHCY
SCHEMBL9569562 0.86 ADORA2A (0.48) ADORA2AADORA1FGFR1SLC22A6AHCY

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-0532423-A1 Novel unsaturated acyclic phosphonate derivatives of purine and pyrimidine MERRELL DOW PHARMACEUTICALS INC. (US) 1993-03-17 EP claimed