SCHEMBL8955888

SCHEMBL8955888

CC(C)C(C)n1cnc2c(N)ncnc21

nearest known ligand 0.75

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ADORA2A P29274 5/20 0.75
▸ ADORA1 P30542 5/20 0.75
▸ PI4KA P42356 3/20 0.75
▸ PI4K2B Q8TCG2 3/20 0.75
▸ PI4K2A Q9BTU6 3/20 0.75
▸ PI4KB Q9UBF8 3/20 0.75
▸ ADORA2B P29275 2/20 0.75
▸ PDE2A O00408 3/20 0.54
▸ LMNA P02545 1/20 0.54
▸ BLM P54132 1/20 0.54
▸ ADA P00813 4/20 0.52
▸ CYP3A4 P08684 2/20 0.52
▸ PDE4A P27815 1/20 0.52
▸ PDE4B Q07343 1/20 0.52
▸ PDE4C Q08493 1/20 0.52
▸ PDE4D Q08499 1/20 0.52
▸ KDM4E B2RXH2 1/20 0.52
▸ ALDH1A1 P00352 1/20 0.52
▸ CYP1A2 P05177 1/20 0.52
▸ ALOX15 P16050 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
SCHEMBL19779293 1.00 ADORA2A (0.75) ADORA2AADORA1PI4KAPI4K2BPI4K2A
Hydrochloric Acid SCHEMBL30881556 0.88 ADORA2A (0.96) ADORA2AADORA1PI4KAPI4K2BPI4K2A
SCHEMBL754007 0.86 ADORA2A (1.00) ADORA2AADORA1PI4KAPI4K2BPI4K2A
Hydrochloric Acid SCHEMBL9193025 0.85 ADORA2A (0.73) ADORA2AADORA1PI4KAPI4K2BPI4K2A
SCHEMBL24205121 0.84 ADORA2A (0.77) ADORA2AADORA1PI4KAPI4K2BPI4K2A
SCHEMBL18521145 0.84 ADORA2A (0.77) ADORA2AADORA1PI4KAPI4K2BPI4K2A
SCHEMBL179458 0.83 ADORA2A (0.71) ADORA2AADORA1PI4KAPI4K2BPI4K2A
SCHEMBL179437 0.83 ADORA2A (0.71) ADORA2AADORA1PI4KAPI4K2BPI4K2A
SCHEMBL179409 0.83 ADORA2A (0.71) ADORA2AADORA1PI4KAPI4K2BPI4K2A
SCHEMBL5016844 0.83 ADORA2A (0.75) ADORA2AADORA1PI4KAPI4K2BPI4K2A

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
EP-0689595-A1 PLANT PROMOTER, MICROORGANISMS AND PLANT CELLS CONTAINING A UNIT FOR THE EXPRESSION OF A PROTEIN OF INTEREST COMPRISING SAID PROMOTER SANOFI (FR) 1996-01-03 — — EP disclosed
WO-1994021793-A1 PLANT PROMOTER, MICROORGANISMS AND PLANT CELLS CONTAINING A UNIT FOR THE EXPRESSION OF A PROTEIN OF INTEREST COMPRISING SAID PROMOTER RUSTICA PROGRAIN GENETIQUE (FR) 1994-09-29 — — WO disclosed
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