SCHEMBL10675784

SCHEMBL10675784

Nc1nc(N)c2nnn([C@H]3C[C@@H](CO)[C@H](O)[C@@H]3O)c2n1

nearest known ligand 0.68

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ AHCY P23526 8/20 0.68
▸ P2RY12 Q9H244 8/20 0.48
▸ ADORA2B P29275 1/20 0.44

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
SCHEMBL10675799 1.00 AHCY (0.68) AHCYP2RY12ADORA2B
SCHEMBL10675420 0.84 AHCY (0.56) AHCYP2RY12ADORA2B
SCHEMBL10675411 0.84 AHCY (0.56) AHCYP2RY12ADORA2B
SCHEMBL20191359 0.81 AHCY (1.00) AHCYP2RY12ADORA2B
SCHEMBL10672795 0.78 AHCY (0.57) AHCYP2RY12ADORA2B
SCHEMBL10672801 0.78 AHCY (0.57) AHCYP2RY12ADORA2B
SCHEMBL10672807 0.78 AHCY (0.57) AHCYP2RY12ADORA2B
SCHEMBL9679650 0.77 AHCY (0.47) AHCYP2RY12ADORA2B
SCHEMBL10673149 0.76 AHCY (1.00) AHCYADORA2B
SCHEMBL10673142 0.76 AHCY (1.00) 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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