SCHEMBL9350433

SCHEMBL9350433

NSc1ncnc2c1cnn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ATG7 O95352 1/20 0.53
▸ ADA P00813 1/20 0.51
▸ ADK P55263 3/20 0.50
▸ DOT1L Q8TEK3 2/20 0.50
▸ DCLK1 O15075 1/20 0.50
▸ DAPK3 O43293 1/20 0.50
▸ DYRK3 O43781 1/20 0.50
▸ CDK1 P06493 1/20 0.50
▸ ROS1 P08922 1/20 0.50
▸ RPS6KB1 P23443 1/20 0.50
▸ CDK2 P24941 1/20 0.50
▸ FLT3 P36888 1/20 0.50
▸ CSNK1A1 P48729 1/20 0.50
▸ CSNK1D P48730 1/20 0.50
▸ CLK2 P49760 1/20 0.50
▸ IRAK1 P51617 1/20 0.50
▸ CDK5 Q00535 1/20 0.50
▸ DYRK1A Q13627 1/20 0.50
▸ MELK Q14680 1/20 0.50
▸ NTRK3 Q16288 1/20 0.50

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
SCHEMBL11210339 0.89 ADA (0.50) ATG7ADAADKDOT1LDCLK1
SCHEMBL11213318 0.89 ADA (0.50) ATG7ADAADKDOT1LDCLK1
SCHEMBL11210952 0.87 SLC29A1 (0.49) ATG7ADASLC29A1
SCHEMBL30935868 0.86 ADA (0.47) ATG7ADAADKDOT1LHSPA5
SCHEMBL30935809 0.85 SLC29A1 (0.50) ATG7ADASLC29A1
SCHEMBL29273711 0.85 SLC29A1 (0.50) ATG7ADASLC29A1
SCHEMBL1737936 0.85 ATG7 (0.69) ATG7ADAADKDOT1LDCLK1
SCHEMBL29325546 0.85 ATG7 (0.69) ATG7ADAADKDOT1LDCLK1
SCHEMBL4085704 0.85 ATG7 (0.69) ATG7ADAADKDOT1LDCLK1
SCHEMBL29325550 0.85 ATG7 (0.69) ATG7ADAADKDOT1LDCLK1

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-0353268-B1 ANTITUMOR 6-SULFENAMIDE, 6-SULFINAMIDE AND 6-SULFONAMIDE PURINES, PURINE NUCLEOSIDES, PURINE NUCLEOTIDES AND RELATED COMPOUNDS NUCLEIC ACID RESEARCH INST (US) 1994-08-10 — — EP disclosed
EP-0353268-A4 ANTITUMOR 6-SULFENAMIDE, 6-SULFINAMIDE AND 6-SULFONAMIDE PURINES, PURINE NUCLEOSIDES, PURINE NUCLEOTIDES AND RELATED COMPOUNDS. NUCLEIC ACID RES INST (US) 1990-05-14 — — EP disclosed
EP-0353268-A1 ANTITUMOR 6-SULFENAMIDE, 6-SULFINAMIDE AND 6-SULFONAMIDE PURINES, PURINE NUCLEOSIDES, PURINE NUCLEOTIDES AND RELATED COMPOUNDS. NUCLEIC ACID RESEARCH INST (US) 1990-02-07 — — EP disclosed
WO-1989005817-A1 ANTITUMOR 6-SULFENAMIDE, 6-SULFINAMIDE AND 6-SULFONAMIDE PURINES, PURINE NUCLEOSIDES, PURINE NUCLEOTIDES AND RELATED COMPOUNDS NUCLEIC ACID RESEARCH INSTITUTE (US) 1989-06-29 — — WO disclosed
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