SCHEMBL9569748

SCHEMBL9569748

Nc1ncnc2c1ncn2CCC(O)/C=C/P(=O)(O)O

nearest known ligand 0.55

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
FGFR1 P11362 1/20 0.55
SLC22A6 Q4U2R8 1/20 0.55
ADORA2A P29274 6/20 0.53
ADORA1 P30542 3/20 0.53
AHCY P23526 4/20 0.53
ADCY5 O95622 3/20 0.50
ALDH1A1 P00352 1/20 0.50
ADORA2B P29275 1/20 0.50
CYP3A4 P08684 1/20 0.49

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
SCHEMBL9569751 1.00 FGFR1 (0.55) FGFR1SLC22A6ADORA2AADORA1AHCY
SCHEMBL9569755 1.00 FGFR1 (0.55) FGFR1SLC22A6ADORA2AADORA1AHCY
SCHEMBL9569658 0.88 AHCY (0.59) FGFR1SLC22A6ADORA2AADORA1AHCY
SCHEMBL9569678 0.88 AHCY (0.59) FGFR1SLC22A6ADORA2AADORA1AHCY
SCHEMBL9569692 0.88 AHCY (0.59) FGFR1SLC22A6ADORA2AADORA1AHCY
SCHEMBL9569750 0.86 ADORA2A (0.54) FGFR1SLC22A6ADORA2AADORA1AHCY
SCHEMBL9569753 0.86 ADORA2A (0.54) FGFR1SLC22A6ADORA2AADORA1AHCY
SCHEMBL9569758 0.86 ADORA2A (0.54) FGFR1SLC22A6ADORA2AADORA1AHCY
SCHEMBL9569537 0.85 ADORA2A (0.50) FGFR1SLC22A6ADORA2AADORA1AHCY
SCHEMBL9569515 0.85 ADORA2A (0.50) FGFR1SLC22A6ADORA2AADORA1AHCY

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