SCHEMBL1971985

SCHEMBL1971985

O=C(Nc1nc2c(ncn2[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c(=O)[nH]1)OCC1c2ccccc2-c2ccccc21

nearest known ligand 0.57

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ TAS1R3 Q7RTX0 1/20 0.56
▸ TAS1R1 Q7RTX1 1/20 0.56
▸ HINT1 P49773 5/20 0.54
▸ HPGD P15428 1/20 0.54
▸ ADORA3 P0DMS8 1/20 0.54
▸ ADORA2A P29274 1/20 0.54
▸ ADORA1 P30542 1/20 0.54
▸ GSK3A P49840 2/20 0.48
▸ RPS6KA3 P51812 2/20 0.48
▸ MAPK14 Q16539 2/20 0.48
▸ PAX8 Q06710 1/20 0.47
▸ IMPDH2 P12268 2/20 0.46

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
SCHEMBL1971988 1.00 TAS1R3 (0.56) TAS1R3TAS1R1HINT1HPGDADORA3
SCHEMBL8930301 0.88 TAS1R3 (0.56) TAS1R3TAS1R1HINT1HPGDADORA3
SCHEMBL8930298 0.88 TAS1R3 (0.56) TAS1R3TAS1R1HINT1HPGDADORA3
SCHEMBL3180065 0.86 POLA1 (0.54) TAS1R3TAS1R1HINT1ADORA3ADORA1
SCHEMBL12729619 0.86 POLA1 (0.54) TAS1R3TAS1R1HINT1ADORA3ADORA1
SCHEMBL3180060 0.86 POLA1 (0.54) TAS1R3TAS1R1HINT1ADORA3ADORA1
SCHEMBL5353859 0.85 TAS1R3 (0.47) TAS1R3TAS1R1HINT1HPGDADORA3
SCHEMBL8930105 0.83 HINT1 (0.59) TAS1R3TAS1R1HINT1HPGDADORA3
SCHEMBL8930109 0.83 HINT1 (0.59) TAS1R3TAS1R1HINT1HPGDADORA3
SCHEMBL8448871 0.83 HINT1 (0.49) TAS1R3TAS1R1HINT1HPGDADORA3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10287313-B2 RNA monomers containing 0-acetal levulinyl ester groups and their use in RNA microarrays THE ROYAL INSTITUTION FOR THE ADVANCEMENT OF LEARNING/MCGILL UNIVERSITY (CA) 2019-05-14 — — US disclosed
US-20160340382-A1 RNA MONOMERS CONTAINING O-ACETAL LEVULINYL ESTER GROUPS AND THEIR USE IN RNA MICROARRAYS THE ROYAL INSTITUTION FOR THE ADVANCEMENT OF LEARNING/MCGILL UNIVERSITY (CA) 2016-11-24 — — US disclosed
EP-2334692-B1 RNA MONOMERS CONTAINING O-ACETAL LEVULINYL ESTER GROUPS AND THEIR USE IN RNA MICROARRAYS UNIV MCGILL (CA) 2016-04-13 — — EP disclosed
US-9249175-B2 RNA monomers containing O-acetal levulinyl ester groups and their use in RNA microarrays THE ROYAL INSTITUTE FOR THE ADVANCEMENT OF LEARNING/MCGILL UNIVERSITY (CA) 2016-02-02 — — US disclosed
CN-102639552-A RNA monomer containing O-acetal levulinyl ester group and application thereof in RNA microarray UNIV MCGILL 2012-08-15 — — CN disclosed
US-20120178638-A1 RNA MONOMERS CONTAINING O-ACETAL LEVULINYL ESTER GROUPS AND THEIR USE IN RNA MICROARRAYS WISCONSIN ALUMNI RESEARCH FOUNDATION (US) 2012-07-12 — — US disclosed
EP-2334692-A1 RNA MONOMERS CONTAINING O-ACETAL LEVULINYL ESTER GROUPS AND THEIR USE IN RNA MICROARRAYS The Royal Institution for the Advancement of Learning / McGill University (CA) 2011-06-22 — — EP disclosed
WO-2010025566-A1 RNA MONOMERS CONTAINING O-ACETAL LEVULINYL ESTER GROUPS AND THEIR USE IN RNA MICROARRAYS THE ROYAL INSTITUTION FOR THE ADVANCEMENT OF LEARNING/MCGILL UNIVERSITY (CA) 2010-03-11 — — 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 (3 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-10287313-B2 RNA monomers containing 0-acetal levulinyl ester groups and their use in RNA microarrays EFTUD2, RNMT, NSUN2 TAS1R3 3717/4885TAS1R1 4056/4885HINT1 3686/4885
US-20160340382-A1 RNA MONOMERS CONTAINING O-ACETAL LEVULINYL ESTER GROUPS AND THEIR USE IN RNA MICROARRAYS EFTUD2, RNMT, RNGTT TAS1R3 3786/4885TAS1R1 4180/4885HINT1 3729/4885
US-20120178638-A1 RNA MONOMERS CONTAINING O-ACETAL LEVULINYL ESTER GROUPS AND THEIR USE IN RNA MICROARRAYS EFTUD2, RNMT, RNGTT TAS1R3 3786/4885TAS1R1 4180/4885HINT1 3729/4885

“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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