SCHEMBL6863967

SCHEMBL6863967

COC(C)O[C@@]1(O)[C@H](O)[C@@H](CO)O[C@H]1n1cnc2c(=O)[nH]c(N)nc21

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HPGD P15428 2/20 0.50
▸ HINT1 P49773 4/20 0.46
▸ ADORA2A P29274 2/20 0.46
▸ ADORA3 P0DMS8 1/20 0.45
▸ NT5E P21589 1/20 0.44
▸ GSK3A P49840 2/20 0.44
▸ RPS6KA3 P51812 2/20 0.44
▸ MAPK14 Q16539 2/20 0.44
▸ TAAR1 Q96RJ0 1/20 0.43
▸ POLB P06746 1/20 0.42
▸ TGM2 P21980 1/20 0.41
▸ MEN1 O00255 1/20 0.41
▸ ALDH1A1 P00352 1/20 0.41
▸ LMNA P02545 1/20 0.41
▸ CYP3A4 P08684 1/20 0.41
▸ NFKB1 P19838 1/20 0.41
▸ BLM P54132 1/20 0.41
▸ VCP P55072 1/20 0.41
▸ KMT2A Q03164 1/20 0.41
▸ SMN1; SMN2 Q16637 1/20 0.41

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
SCHEMBL858664 0.90 HPGD (0.54) HPGDHINT1ADORA2AADORA3NT5E
SCHEMBL2533734 0.87 HPGD (0.51) HPGDHINT1ADORA2AADORA3NT5E
SCHEMBL31011272 0.87 HPGD (0.50) HPGDHINT1ADORA2AADORA3NT5E
SCHEMBL23883607 0.86 HPGD (0.50) HPGDHINT1ADORA2AADORA3NT5E
SCHEMBL6512797 0.84 HPGD (0.48) HPGDHINT1ADORA2AADORA3NT5E
SCHEMBL31225342 0.84 ADORA2A (0.51) HPGDHINT1ADORA2AADORA3NT5E
SCHEMBL18636462 0.84 ADORA2A (0.51) HPGDHINT1ADORA2AADORA3NT5E
SCHEMBL6515281 0.84 HPGD (0.47) HPGDHINT1ADORA2AADORA3NT5E
2'-B-Methyl-Guanosine SCHEMBL14853673 0.83 ADORA2A (0.65) HPGDHINT1ADORA2AADORA3NT5E
2'-B-Methyl-Guanosine SCHEMBL21007207 0.83 ADORA2A (0.65) HPGDHINT1ADORA2AADORA3NT5E

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6111094-A OLIGONUCLEOTIDE WITH AT LEAST ONE 2' MODIFICATION; FOR MODULATION OF HUMAN INTRACELLULAR ADHESION MOLECULE-1; ANTIINFLAMMATORY/ANTICARCINOGENIC/ ANTIMETASTASIS AGENTS; ANTIARTHRITIC AGENTS; TREATMENT OF SKIN DISORDERS ISIS PHARMACEUTICALS INC. (US) 2000-08-29 — — US claimed
WO-2022150369-A1 COMPOUNDS FOR THE TREATMENT OF BATTEN DISEASE EXICURE OPERATING COMPANY (US) 2022-07-14 — — WO disclosed
WO-2022147541-A1 COMPOUNDS FOR MODULATING SCN9A EXPRESSION EXICURE OPERATING COMPANY (US) 2022-07-07 — — WO disclosed
US-6800751-B2 ALKYLATION OF 2'-HYDROXY GROUP OF RIBONUCLEOSIDE PROTECTED WITH INVENTIVE SILYLATING AGENTS IN PRESENCE OF EXCESS OF MILD HINDERED BASE MAY BE CARRIED OUT WITHOUT PROTECTING EXOCYCLIC AMINE AND OXO FUNCTIONALITIES OF NUCLEOBASES ISIS PHARMACEUTICALS, INC. 2004-10-05 — — US disclosed
US-20030225262-A1 Reagent and process for protecting active groups IONIS PHARMACEUTICALS, INC. 2003-12-04 — — US disclosed
WO-2003087053-A2 REAGENT AND PROCESS FOR PROTECTING NUCLEOSIDE ACTIVE GROUPS ISIS PHARMACEUTICALS, INC. (US) 2003-10-23 — — WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20030225262-A1 Reagent and process for protecting active groups TRDMT1, SBDS, DIMT1 HPGD 367/4885HINT1 556/4885ADORA2A 1249/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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