SCHEMBL7063499

SCHEMBL7063499

CC(C)(C)[Si](OC[C@H]1O[C@@H](n2cnc3c(=O)[nH]c(N)nc32)[C@H](OCCO)[C@@H]1O)(c1ccccc1)c1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ HINT1 P49773 6/20 0.53
▸ TAS1R3 Q7RTX0 1/20 0.53
▸ TAS1R1 Q7RTX1 1/20 0.53
▸ GSK3A P49840 2/20 0.51
▸ RPS6KA3 P51812 2/20 0.51
▸ MAPK14 Q16539 2/20 0.51
▸ NT5E P21589 2/20 0.49
▸ PNP P00491 1/20 0.47
▸ TGM2 P21980 1/20 0.47
▸ TAAR1 Q96RJ0 1/20 0.47
▸ HPGD P15428 1/20 0.46
▸ KRAS P01116 4/20 0.45
▸ FUT5 Q11128 1/20 0.44

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
SCHEMBL7063503 1.00 HINT1 (0.53) HINT1TAS1R3TAS1R1GSK3ARPS6KA3
SCHEMBL5505060 0.92 HINT1 (0.47) HINT1TAS1R3TAS1R1GSK3ARPS6KA3
SCHEMBL6468412 0.91 HINT1 (0.64) HINT1GSK3ARPS6KA3MAPK14NT5E
SCHEMBL17936222 0.91 HINT1 (0.64) HINT1GSK3ARPS6KA3MAPK14NT5E
SCHEMBL881724 0.88 NT5E (0.57) HINT1TAS1R3TAS1R1GSK3ARPS6KA3
SCHEMBL17198404 0.88 HINT1 (0.54) HINT1TAS1R3TAS1R1GSK3ARPS6KA3
SCHEMBL7064861 0.87 TAS1R3 (0.47) HINT1TAS1R3TAS1R1GSK3ARPS6KA3
SCHEMBL7064857 0.87 TAS1R3 (0.47) HINT1TAS1R3TAS1R1GSK3ARPS6KA3
SCHEMBL7063474 0.84 ADORA1 (0.60) TAS1R3TAS1R1NT5E
SCHEMBL7063471 0.84 ADORA1 (0.60) TAS1R3TAS1R1NT5E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6624294-B2 Dissolving nucleoside in solvent to form a solution; cooling; treating with base; warming; reacting with ester to effect alkylation of 2' position of a 2',3'-dihydroxy sugar moiety of a nucleoside ISIS PHARMACEUTICALS, INC. 2003-09-23 — — US disclosed
US-20030078415-A1 Regioselective synthesis of 2'-O-modified nucleosides IONIS PHARMACEUTICALS, INC. 2003-04-24 — — US disclosed
US-6403779-B1 DISSOLVING NUCLEOSIDE IN APROTIC SOLVENT, COOLING, TREATING WITH BASE, WARMING MIXTURE, COOLING, REACTING WITH REACTIVE ESTER TO EFFECT ALKYLATION ISIS PHARMACEUTICALS, INC. 2002-06-11 — — US 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-20030078415-A1 Regioselective synthesis of 2'-O-modified nucleosides NSUN2, NT5C3B, RNGTT HINT1 260/4885TAS1R3 4469/4885TAS1R1 4761/4885

“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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