SCHEMBL17826000

SCHEMBL17826000

OC[C@H]1OC(n2cnc3c(NCc4ccc(Cl)o4)ncnc32)[C@@H](O)[C@@H]1O

nearest known ligand 0.73

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ ADORA3 P0DMS8 5/20 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
▸ TDP1 Q9NUW8 1/20 0.70
▸ ADORA2A P29274 2/20 0.69
▸ ADORA1 P30542 2/20 0.69
▸ PRKAG1 P54619 1/20 0.66
▸ PRKAA1 Q13131 1/20 0.66
▸ PRKAB1 Q9Y478 1/20 0.66

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
SCHEMBL19583109 1.00 ADORA3 (0.72) ADORA3SLC29A1TP53PAX8SMN1; SMN2
SCHEMBL17825928 0.90 SLC29A1 (0.73) ADORA3SLC29A1TP53PAX8SMN1; SMN2
SCHEMBL19583100 0.90 SLC29A1 (0.73) ADORA3SLC29A1TP53PAX8SMN1; SMN2
SCHEMBL17825992 0.89 ADORA3 (0.72) ADORA3SLC29A1TP53PAX8SMN1; SMN2
SCHEMBL14713281 0.89 ADORA3 (0.72) ADORA3SLC29A1TP53PAX8SMN1; SMN2
SCHEMBL19583070 0.89 SLC29A1 (0.72) ADORA3SLC29A1TP53PAX8SMN1; SMN2
SCHEMBL17826002 0.89 SLC29A1 (0.72) ADORA3SLC29A1TP53PAX8SMN1; SMN2
SCHEMBL20626317 0.89 ADORA3 (0.72) ADORA3SLC29A1TP53PAX8SMN1; SMN2
SCHEMBL20626318 0.89 ADORA3 (0.72) ADORA3SLC29A1TP53PAX8SMN1; SMN2
SCHEMBL17825994 0.89 SLC29A1 (0.72) 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3229772-A1 6-ARYL-9-GLYCOSYLPURINES AND USE THEREOF Univerzita Palackého v Olomouci (CZ) 2017-10-18 — — EP claimed
WO-2016091236-A1 6-ARYL-9-GLYCOSYLPURINES AND USE THEREOF UNIVERZITA PALACKEHO V OLOMOUCI (CZ) 2016-06-16 — — WO claimed
EP-3229772-A1 6-ARYL-9-GLYCOSYLPURINES AND USE THEREOF Univerzita Palackého v Olomouci (CZ) 2017-10-18 — — EP disclosed
WO-2016091236-A1 6-ARYL-9-GLYCOSYLPURINES AND USE THEREOF UNIVERZITA PALACKEHO V OLOMOUCI (CZ) 2016-06-16 — — WO disclosed
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