SCHEMBL10677210

SCHEMBL10677210

CNc1nc(N)nc2c1ncn2C1CC(CO)C(O)C1O

nearest known ligand 0.73

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ AHCY P23526 7/20 0.73
▸ ADORA3 P0DMS8 4/20 0.61
▸ ADORA1 P30542 3/20 0.61
▸ ADORA2B P29275 2/20 0.58
▸ NR1I2 O75469 1/20 0.47
▸ ALB P02768 1/20 0.47
▸ PDE4D Q08499 1/20 0.47
▸ PGK1 P00558 1/20 0.46
▸ PGK2 P07205 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
SCHEMBL10677199 1.00 AHCY (0.73) AHCYADORA3ADORA1ADORA2BNR1I2
SCHEMBL9679237 0.88 AHCY (0.69) AHCYADORA3ADORA1ADORA2BNR1I2
SCHEMBL23587625 0.87 AHCY (0.71) AHCYADORA3ADORA1ADORA2BNR1I2
SCHEMBL23587656 0.87 AHCY (0.71) AHCYADORA3ADORA1ADORA2BNR1I2
SCHEMBL23587626 0.87 AHCY (0.71) AHCYADORA3ADORA1ADORA2BNR1I2
SCHEMBL10673142 0.85 AHCY (1.00) AHCYADORA2B
SCHEMBL10673149 0.85 AHCY (1.00) AHCYADORA2B
SCHEMBL14825312 0.83 AHCY (0.69) AHCYADORA3ADORA1ADORA2B
SCHEMBL14825393 0.83 AHCY (0.69) AHCYADORA3ADORA1ADORA2B
SCHEMBL10679258 0.82 AHCY (0.73) AHCYADORA2B

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4728736-A HERPES VIRUS SOUTHERN RESEARCH INSTITUTE (US) 1988-03-01 — — US claimed
US-4728736-A HERPES VIRUS SOUTHERN RESEARCH INSTITUTE (US) 1988-03-01 — — US disclosed
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