SCHEMBL29100470

SCHEMBL29100470

OCC1OC(n2cnc3c(NCc4ccco4)ncnc32)C(O)C(O)C1O

nearest known ligand 0.98

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ ADORA3 P0DMS8 5/20 0.98
▸ SLC29A1 Q99808 4/20 0.98
▸ TP53 P04637 3/20 0.98
▸ PAX8 Q06710 3/20 0.98
▸ SMN1; SMN2 Q16637 1/20 0.98
▸ MITF O75030 1/20 0.98
▸ LMNA P02545 1/20 0.98
▸ TDP1 Q9NUW8 1/20 0.73
▸ ADORA2A P29274 2/20 0.68
▸ ADORA1 P30542 2/20 0.68
▸ TSHR P16473 1/20 0.68
▸ NFKB1 P19838 1/20 0.68
▸ STAT6 P42226 1/20 0.68
▸ GMNN O75496 1/20 0.68
▸ BLM P54132 1/20 0.68
▸ PMP22 Q01453 1/20 0.68

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
SCHEMBL29697393 1.00 ADORA3 (0.98) ADORA3SLC29A1TP53PAX8SMN1; SMN2
SCHEMBL25170466 1.00 ADORA3 (0.98) ADORA3SLC29A1TP53PAX8SMN1; SMN2
Kinetin Riboside SCHEMBL14713468 0.99 ADORA3 (1.00) ADORA3SLC29A1TP53PAX8SMN1; SMN2
Kinetin Riboside SCHEMBL217034 0.99 ADORA3 (1.00) ADORA3SLC29A1TP53PAX8SMN1; SMN2
Kinetin Riboside SCHEMBL3339041 0.99 ADORA3 (1.00) ADORA3SLC29A1TP53PAX8SMN1; SMN2
Kinetin Riboside SCHEMBL3190271 0.99 ADORA3 (1.00) ADORA3SLC29A1TP53PAX8SMN1; SMN2
Kinetin Riboside SCHEMBL14713232 0.99 ADORA3 (1.00) ADORA3SLC29A1TP53PAX8SMN1; SMN2
Kinetin Riboside SCHEMBL19583061 0.99 ADORA3 (1.00) ADORA3SLC29A1TP53PAX8SMN1; SMN2
Kinetin Riboside SCHEMBL3190252 0.99 ADORA3 (1.00) ADORA3SLC29A1TP53PAX8SMN1; SMN2
Kinetin Riboside SCHEMBL29564117 0.99 ADORA3 (1.00) ADORA3SLC29A1TP53PAX8SMN1; SMN2

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
CN-116814723-B Fermentation method of 5406 streptomycete for simultaneously producing auxin and cytokinin 中国热带农业科学院三亚研究院 2023-12-05 — — CN disclosed
CN-116814723-A Fermentation method of 5406 streptomycete for simultaneously producing auxin and cytokinin 中国热带农业科学院三亚研究院 2023-09-29 — — CN disclosed
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