SCHEMBL27741978

SCHEMBL27741978

O=CC(O)[C@@H](O)[C@H]1O[C@@H](n2cnc3c(O)ncnc32)[C@H](O)[C@@H]1O

nearest known ligand 0.52

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
AHCY P23526 6/20 0.50
PRMT5 O14744 5/20 0.48
WDR77 Q9BQA1 5/20 0.48
HIF1A Q16665 1/20 0.47
TMEM97 Q5BJF2 1/20 0.47
SIGMAR1 Q99720 1/20 0.47
ADORA2A P29274 3/20 0.45
ADORA2B P29275 3/20 0.45
HSP90B1 P14625 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
SCHEMBL10365540 0.86 PRMT5 (0.58) AHCYPRMT5WDR77HIF1AADORA2A
SCHEMBL28996759 0.83 AHCY (0.49) AHCYPRMT5WDR77HIF1ATMEM97
SCHEMBL28672423 0.82 PRMT5 (0.53) AHCYPRMT5WDR77HIF1ATMEM97
SCHEMBL6538405 0.82 PRMT5 (0.53) AHCYPRMT5WDR77HIF1ATMEM97
SCHEMBL7744261 0.82 AHCY (0.46) AHCYPRMT5WDR77ADORA2AADORA2B
SCHEMBL5498775 0.82 AHCY (0.51) AHCYPRMT5WDR77HIF1ATMEM97
SCHEMBL28985735 0.82 PRMT5 (0.50) AHCYPRMT5WDR77HIF1ATMEM97
SCHEMBL9155536 0.82 AHCY (0.51) AHCYPRMT5WDR77HIF1ATMEM97
SCHEMBL7744279 0.82 AHCY (0.47) AHCYPRMT5WDR77HIF1ATMEM97
SCHEMBL11884247 0.81 AHCY (0.53) AHCYPRMT5WDR77HIF1ATMEM97

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117083303-A Binding molecules with high affinity and/or specificity and methods of making and using the same 阿拉码生物科学股份有限公司 2023-11-17 CN disclosed
CN-107970451-A TLR activators and the treatment use of therapeutic alliance 帆德制药股份有限公司 2018-05-01 CN disclosed
CN-103458902-B Therapeutic uses of TLR agonists and combination therapies 帆德制药股份有限公司 2017-11-07 CN disclosed
CN-103458902-A Therapeutic uses of TLR agonists and combination therapies VENTIRX PHARMACEUTICALS INC 2013-12-18 CN disclosed
CN-101404883-A Purine compounds and methods of use thereof INOTEK PHARMACEUTICALS CORP (US) 2009-04-08 CN disclosed
CN-101356159-A Substituted isoquinoline-1, 3(2H,4H) -diones, 1-thio-1, 4-dihydro-2H-isoquinoline-3-ones and 1, 4-dihydro-3 (2H) -isoquinolones and their use as kinase inhibitors WYETH CORP (US) 2009-01-28 CN disclosed