SCHEMBL9083885

SCHEMBL9083885

Cn1c(Cl)nc2c(N)nc([C@@H]3C[C@@H]4CC[C@H]3C4)nc21

nearest known ligand 0.33

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ ADORA2A P29274 2/20 0.31

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
SCHEMBL7437563 1.00 ADORA2A (0.31) ADORA2A
SCHEMBL9082502 0.85 ADORA2A (0.40) ADORA2A
SCHEMBL6153485 0.79 ADORA1 (0.36) ADORA2A
SCHEMBL7437584 0.79 PDE8B (0.31) —
SCHEMBL9233825 0.77 CDK1 (0.47) ADORA2A
SCHEMBL6270235 0.77 CDK1 (0.47) ADORA2A
SCHEMBL7434489 0.72 PDE5A (0.34) —
SCHEMBL4879686 0.69 — —
Hydrochloric Acid SCHEMBL4885433 0.68 — —
SCHEMBL6979264 0.67 MEN1 (0.36) ADORA2A

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
US-5565566-A N6-(ENDO(1R,2S,4S)-2-NORBORNYL)-9-METHYLADENINE OR N6-(ENDO(1S,2R,4R)-2-NORBORNYL)-9-METHYLADENINE DISCOVERY THERAPEUTICS, INC. (US) 1996-10-15 — — US disclosed
Send feedback