SCHEMBL8325836

SCHEMBL8325836

OC[C@H]1O[C@@H](n2cnc3c(NCC(c4ccccc4)c4ccccc4)nc(Cl)nc32)C(O)C1O

nearest known ligand 0.80

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ADORA2A P29274 4/20 0.75
ADORA1 P30542 4/20 0.75
ADORA3 P0DMS8 3/20 0.75
ADORA2B P29275 2/20 0.75

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
SCHEMBL1415122 1.00 ADORA2A (0.75) ADORA2AADORA1ADORA3ADORA2B
SCHEMBL1415110 1.00 ADORA2A (0.75) ADORA2AADORA1ADORA3ADORA2B
SCHEMBL1415112 1.00 ADORA2A (0.75) ADORA2AADORA1ADORA3ADORA2B
SCHEMBL1415120 1.00 ADORA2A (0.75) ADORA2AADORA1ADORA3ADORA2B
SCHEMBL10689357 0.95 ADORA2A (0.68) ADORA2AADORA1ADORA3ADORA2B
SCHEMBL10689350 0.95 ADORA2A (0.68) ADORA2AADORA1ADORA3ADORA2B
SCHEMBL10684165 0.89 ADORA2A (0.75) ADORA2AADORA1ADORA3ADORA2B
SCHEMBL6321740 0.89 ADORA2A (0.75) ADORA2AADORA1ADORA3ADORA2B
SCHEMBL10684171 0.89 ADORA2A (0.75) ADORA2AADORA1ADORA3ADORA2B
SCHEMBL7102294 0.88 ADORA2A (0.59) ADORA2AADORA1ADORA3ADORA2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0139358-A2 N6-substituted diarylalkyl adenosines, processes for their production and pharmaceutical compositions comprising the same WARNER-LAMBERT COMPANY (US) 1985-05-02 EP claimed
US-5925624-A ANTIINFLAMMATORY AGENTS TREATING PATIENTS WITH INFLAMMATORY CONDITIONS SUSCEPTIBLE TO LEUKOCYTE-INDUCED TISSUE DAMAGE GLAXO GROUP LIMITED (GB) 1999-07-20 US disclosed
US-5889178-A N-(2,2-DIPHENYLETHYL)-DERIVATIVES GLAXO GROUP LIMITED (GB) 1999-03-30 US disclosed
EP-0680488-B1 2,6-DIAMINOPURINE DERIVATIVES GLAXO GROUP LTD (GB) 1998-04-08 EP disclosed
WO-1996002553-A2 AMINO PURINE-β-D-RIBOFURANURONAMIDE DERIVATIVES GLAXO GROUP LIMITED (GB) 1996-02-01 WO disclosed
EP-0680488-A1 2,6-DIAMINOPURINE DERIVATIVES GLAXO GROUP LIMITED (GB) 1995-11-08 EP disclosed
WO-1994017090-A1 2,6-DIAMINOPURINE DERIVATIVES GLAXO GROUP LIMITED (GB) 1994-08-04 WO disclosed
EP-0251339-A2 N6- substituted diarylalkyl adenosines, processes for their production and pharmaceutical compositions comprising the same WARNER-LAMBERT COMPANY (US) 1988-01-07 EP disclosed