SCHEMBL4425844

SCHEMBL4425844

COC(C)[C@@]1(n2cnc3c(O)ncnc32)O[C@H](CO)[C@@H](O)[C@H]1O

nearest known ligand 0.47

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PRKAG1 P54619 1/20 0.39
PRKAA1 Q13131 1/20 0.39
PRKAB1 Q9Y478 1/20 0.39
ADORA1 P30542 2/20 0.37
PI4KA P42356 1/20 0.37
PI4K2B Q8TCG2 1/20 0.37
PI4K2A Q9BTU6 1/20 0.37
PI4KB Q9UBF8 1/20 0.37
ADORA3 P0DMS8 1/20 0.37
ADORA2A P29274 1/20 0.37

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
SCHEMBL31170697 0.89 PI4KA (0.39) ADORA1PI4KAPI4K2BPI4K2API4KB
SCHEMBL27597373 0.89 PI4KA (0.39) ADORA1PI4KAPI4K2BPI4K2API4KB
SCHEMBL16112350 0.89 PI4KA (0.47) ADORA1PI4KAPI4K2BPI4K2API4KB
SCHEMBL31472972 0.84 PI4KA (0.36) ADORA1PI4KAPI4K2BPI4K2API4KB
SCHEMBL12541776 0.82 PI4KA (0.38) ADORA1PI4KAPI4K2BPI4K2API4KB
SCHEMBL28603431 0.81 PI4KA (0.39) ADORA1PI4KAPI4K2BPI4K2API4KB
SCHEMBL5218286 0.80 ADORA2A (0.44) ADORA1ADORA3ADORA2A
SCHEMBL29974446 0.79 PI4KA (0.40) ADORA1PI4KAPI4K2BPI4K2API4KB
SCHEMBL41364 0.79 PI4KA (0.43) ADORA1PI4KAPI4K2BPI4K2API4KB
SCHEMBL2228473 0.78 PI4KA (0.39) ADORA1PI4KAPI4K2BPI4K2API4KB

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
WO-2024019801-A1 SYSTEMS AND METHODS FOR PROMOTING TRANS-SPLICING TACIT THERAPEUTICS, INC. (US) 2024-01-25 WO disclosed
EP-4125930-A1 DUAL-ACTING SIRNA BASED MODULATION OF C9ORF72 University Of Massachusetts (US) 2023-02-08 EP disclosed
WO-2021195510-A1 DUAL-ACTING SIRNA BASED MODULATION OF C9ORF72 UNIVERSITY OF MASSACHUSETTS (US) 2021-09-30 WO disclosed
CN-106434857-A TD probe and its uses SEEGENE株式会社 2017-02-22 CN disclosed
CN-106399484-A Double bubble shape fluorescence probe, applications thereof, and kit 中国人民解放军第三军医大学第附属医院 2017-02-15 CN disclosed
CN-102770556-B Targeted probes and uses thereof SEEGENE株式会社 2016-09-14 CN disclosed
EP-2046993-A2 RNA SILENCING COMPOSITIONS AND METHODS FOR THE TREATMENT OF HUNTINGTON'S DISEASE University of Massachusetts (US) 2009-04-15 EP disclosed
WO-2008005562-A2 RNA SILENCING COMPOSITIONS AND METHODS FOR THE TREATMENT OF HUNTINGTON'S DISEASE UNIVERSITY OF MASSACHUSETTS (US) 2008-01-10 WO disclosed