SCHEMBL31439405

SCHEMBL31439405

CCCCC(=O)N(O)c1nc(SC)nc2c1ncn2[C@]1(C(N)=O)O[C@H](CO)[C@@H](O)[C@H]1O

nearest known ligand 0.37

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ ADORA3 P0DMS8 2/20 0.33
▸ SLC29A1 Q99808 2/20 0.31
▸ KDM4E B2RXH2 1/20 0.31
▸ PKM P14618 1/20 0.31
▸ ADORA2A P29274 3/20 0.30
▸ ADORA2B P29275 3/20 0.30
▸ ADORA1 P30542 1/20 0.30

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
SCHEMBL28417275 1.00 ADORA3 (0.33) ADORA3SLC29A1KDM4EPKMADORA2A
SCHEMBL28758954 0.86 SLC29A1 (0.37) ADORA3SLC29A1ADORA2AADORA2B
SCHEMBL28521252 0.84 HTR2C (0.31) KDM4EPKM
SCHEMBL31192291 0.84 HTR2C (0.31) KDM4EPKM
SCHEMBL29407144 0.80 KDM4E (0.31) KDM4EPKM
SCHEMBL29043762 0.80 KDM4E (0.31) KDM4EPKM
SCHEMBL26090156 0.74 HTR2B (0.35) ADORA3KDM4EPKMADORA1
SCHEMBL29413061 0.74 HTR2B (0.35) ADORA3KDM4EPKMADORA1
SCHEMBL28660589 0.73 LMNA (0.33) ADORA3SLC29A1ADORA2AADORA1
SCHEMBL31406536 0.69 ADORA2A (0.36) ADORA2AADORA2B

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
CN-119604304-A Recombinant RNA molecules comprising an untranslated region or a segment encoding spike protein from the Severe acute respiratory coronavirus 2 Omikovia strain 葛兰素史克生物有限公司 2025-03-11 — — CN disclosed
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