SCHEMBL9684255

SCHEMBL9684255

Nc1ncnc2c1ncn2C1CCC(OCP(=O)(O)O)C1

nearest known ligand 0.72

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ADCY5 O95622 11/20 0.72
ADORA2A P29274 4/20 0.57
PI4KA P42356 3/20 0.52
PI4K2B Q8TCG2 3/20 0.52
PI4K2A Q9BTU6 3/20 0.52
PI4KB Q9UBF8 3/20 0.52
ADORA3 P0DMS8 2/20 0.52
ADORA1 P30542 2/20 0.52
ADORA2B P29275 1/20 0.52

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
SCHEMBL10421735 0.92 ADCY5 (0.60) ADCY5ADORA2API4KAPI4K2BPI4K2A
SCHEMBL15948724 0.92 ADCY5 (0.60) ADCY5ADORA2API4KAPI4K2BPI4K2A
SCHEMBL9685083 0.87 ADCY5 (0.54) ADCY5ADORA2A
SCHEMBL8660803 0.86 ADCY5 (0.65) ADCY5ADORA2API4KAPI4K2BPI4K2A
SCHEMBL9685322 0.84 YTHDC1 (0.60) ADCY5ADORA3ADORA1
SCHEMBL6045769 0.83 ADCY5 (1.00) ADCY5ADORA2API4KAPI4K2BPI4K2A
SCHEMBL6045745 0.83 ADCY5 (1.00) ADCY5ADORA2API4KAPI4K2BPI4K2A
SCHEMBL6045770 0.83 ADCY5 (1.00) ADCY5ADORA2API4KAPI4K2BPI4K2A
SCHEMBL6045813 0.83 ADCY5 (1.00) ADCY5ADORA2API4KAPI4K2BPI4K2A
SCHEMBL9685235 0.83 ADCY5 (0.64) ADCY5ADORA2API4KAPI4K2BPI4K2A

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-0468119-A1 Novel carbocyclic analogs of certain nucleosides MERRELL DOW PHARMACEUTICALS INC. (US) 1992-01-29 EP disclosed