SCHEMBL28021059

SCHEMBL28021059

Cc1ccc(CNc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)o1

nearest known ligand 0.73

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ ADORA3 P0DMS8 4/20 0.72
▸ SLC29A1 Q99808 4/20 0.72
▸ TP53 P04637 3/20 0.72
▸ PAX8 Q06710 3/20 0.72
▸ SMN1; SMN2 Q16637 1/20 0.72
▸ MITF O75030 1/20 0.72
▸ LMNA P02545 1/20 0.72
▸ ADORA2A P29274 1/20 0.71
▸ ADORA1 P30542 1/20 0.71
▸ TSHR P16473 1/20 0.71
▸ NFKB1 P19838 1/20 0.71
▸ STAT6 P42226 1/20 0.71
▸ GMNN O75496 1/20 0.71
▸ BLM P54132 1/20 0.71
▸ PMP22 Q01453 1/20 0.71
▸ TDP1 Q9NUW8 1/20 0.70

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
SCHEMBL20626317 1.00 ADORA3 (0.72) ADORA3SLC29A1TP53PAX8SMN1; SMN2
SCHEMBL20626318 1.00 ADORA3 (0.72) ADORA3SLC29A1TP53PAX8SMN1; SMN2
SCHEMBL14714035 1.00 ADORA3 (0.72) ADORA3SLC29A1TP53PAX8SMN1; SMN2
SCHEMBL14713281 1.00 ADORA3 (0.72) ADORA3SLC29A1TP53PAX8SMN1; SMN2
SCHEMBL17825992 1.00 ADORA3 (0.72) ADORA3SLC29A1TP53PAX8SMN1; SMN2
SCHEMBL19583113 1.00 ADORA3 (0.72) ADORA3SLC29A1TP53PAX8SMN1; SMN2
SCHEMBL17825957 0.90 ADORA3 (0.69) ADORA3SLC29A1TP53PAX8SMN1; SMN2
SCHEMBL19583002 0.90 ADORA3 (0.69) ADORA3SLC29A1TP53PAX8SMN1; SMN2
SCHEMBL19583100 0.90 SLC29A1 (0.73) ADORA3SLC29A1TP53PAX8SMN1; SMN2
SCHEMBL17825928 0.90 SLC29A1 (0.73) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102812033-B N6-substituted adenosine derivatives and N6-substituted adenine derivatives and uses thereof INSTITUTE OF MATARIA MEDICA, CHINESE ACADEMY OF MEDICAL SCIENCES (CN) 2015-11-25 — — CN claimed
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