SCHEMBL4278130

SCHEMBL4278130

C[C@H]1O[C@@H](n2cnc3c(=O)[nH]c(N)nc32)C(O)C1O

nearest known ligand 0.62

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ HINT1 P49773 5/20 0.62
▸ ADORA3 P0DMS8 1/20 0.61
▸ NT5E P21589 1/20 0.59
▸ STING1 Q86WV6 3/20 0.58
▸ PDE3B Q13370 1/20 0.58
▸ PDE3A Q14432 1/20 0.58
▸ TAAR1 Q96RJ0 1/20 0.57
▸ GSK3A P49840 2/20 0.55
▸ RPS6KA3 P51812 2/20 0.55
▸ MAPK14 Q16539 2/20 0.55
▸ TGM2 P21980 1/20 0.55
▸ HPGD P15428 1/20 0.54
▸ PNP P00491 1/20 0.53
▸ FUT5 Q11128 1/20 0.53

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
SCHEMBL24299397 1.00 HINT1 (0.62) HINT1ADORA3NT5ESTING1PDE3B
SCHEMBL16114092 1.00 HINT1 (0.62) HINT1ADORA3NT5ESTING1PDE3B
SCHEMBL19938159 1.00 HINT1 (0.62) HINT1ADORA3NT5ESTING1PDE3B
SCHEMBL13833323 1.00 HINT1 (0.62) HINT1ADORA3NT5ESTING1PDE3B
SCHEMBL2510562 1.00 HINT1 (0.62) HINT1ADORA3NT5ESTING1PDE3B
SCHEMBL27221934 0.99 HINT1 (0.61) HINT1ADORA3NT5ESTING1PDE3B
Phosphoric Acid SCHEMBL1299515 0.96 NT5E (0.63) HINT1ADORA3NT5ESTING1PDE3B
Phosphoric Acid SCHEMBL25402859 0.96 NT5E (0.63) HINT1ADORA3NT5ESTING1PDE3B
SCHEMBL21232923 0.92 HINT1 (0.56) HINT1ADORA3NT5ESTING1PDE3B
Phosphoric Acid SCHEMBL17505120 0.92 NT5E (0.61) HINT1ADORA3NT5ESTING1PDE3B

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 27 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0787138-B1 RADIOACTIVE PHOSPHOROUS LABELING OF PROTEINS FOR TARGETED RADIOTHERAPY IMMUNOMEDICS INC (US) 2006-06-28 — — EP claimed
EP-0787138-A4 RADIOACTIVE PHOSPHOROUS LABELING OF PROTEINS FOR TARGETED RADIOTHERAPY IMMUNOMEDICS INC (US) 2000-03-08 — — EP claimed
US-5976492-A Radioactive phosphorus labeled proteins for targeted radiotherapy IMMUNOMEDICS, INC. (US) 1999-11-02 — — US claimed
US-5728369-A Radioactive phosphorus labeling of proteins for targeted radiotherapy IMMUNOMEDICS, INC. (US) 1998-03-17 — — US claimed
EP-0787138-A1 RADIOACTIVE PHOSPHOROUS LABELING OF PROTEINS FOR TARGETED RADIOTHERAPY Immunomedics, Inc. (US) 1997-08-06 — — EP claimed
WO-1996011208-A1 RADIOACTIVE PHOSPHOROUS LABELING OF PROTEINS FOR TARGETED RADIOTHERAPY IMMUNOMEDICS, INC. (US) 1996-04-18 — — WO claimed
WO-2024119117-A1 MODIFIED 5' CAP FOR MRNA AND METHODS OF USE THEREOF PRIME MEDICINE, INC. (US) 2024-06-06 — — WO disclosed
US-20240166675-A1 NOVEL PHOSPHOROUS (V)-BASED REAGENTS, PROCESSES FOR THE PREPARATION THEREOF, AND THEIR USE IN MAKING STEREO-DEFINED ORGANOPHOSHOROUS (V) COMPOUNDS BRISTOL-MYERS SQUIBB COMPANY 2024-05-23 — — US disclosed
US-11421223-B2 Processes and host cells for genome, pathway, and biomolecular engineering ENEVOLV, INC. (US) 2022-08-23 — — US disclosed
US-20210230638-A1 SYSTEMS AND METHODS FOR THE TREATMENT OF HEMOGLOBINOPATHIES EDITAS MEDICINE, INC. (US) 2021-07-29 — — US disclosed
US-10513520-B2 Sulfamide and sulfamate inhibitors of hHint1 REGENTS OF THE UNIVERSITY OF MINNESOTA (US) 2019-12-24 — — US disclosed
US-20190309289-A1 PROCESSES AND HOST CELLS FOR GENOME, PATHWAY, AND BIOMOLECULAR ENGINEERING ENEVOLV, INC. 2019-10-10 — — US disclosed
US-10370654-B2 Processes and host cells for genome, pathway, and biomolecular engineering ENEVOLV, INC. (US) 2019-08-06 — — US disclosed
WO-2008112980-A2 METHOD AND SYSTEM FOR ASSEMBLY OF MACROMOLECULES AND NANOSTRUCTURES INCITOR, LLC (US) 2008-09-18 — — WO disclosed
EP-0787138-B1 RADIOACTIVE PHOSPHOROUS LABELING OF PROTEINS FOR TARGETED RADIOTHERAPY IMMUNOMEDICS INC (US) 2006-06-28 — — EP disclosed
EP-0787138-A4 RADIOACTIVE PHOSPHOROUS LABELING OF PROTEINS FOR TARGETED RADIOTHERAPY IMMUNOMEDICS INC (US) 2000-03-08 — — EP disclosed
US-5976492-A Radioactive phosphorus labeled proteins for targeted radiotherapy IMMUNOMEDICS, INC. (US) 1999-11-02 — — US disclosed
US-5728369-A Radioactive phosphorus labeling of proteins for targeted radiotherapy IMMUNOMEDICS, INC. (US) 1998-03-17 — — US disclosed
EP-0787138-A1 RADIOACTIVE PHOSPHOROUS LABELING OF PROTEINS FOR TARGETED RADIOTHERAPY Immunomedics, Inc. (US) 1997-08-06 — — EP disclosed
WO-1996011208-A1 RADIOACTIVE PHOSPHOROUS LABELING OF PROTEINS FOR TARGETED RADIOTHERAPY IMMUNOMEDICS, INC. (US) 1996-04-18 — — 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 (2 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-10513520-B2 Sulfamide and sulfamate inhibitors of hHint1 GRIN1, OPRL1, GRIN3A HINT1 131/4885ADORA3 450/4885NT5E 2442/4885
US-20240166675-A1 NOVEL PHOSPHOROUS (V)-BASED REAGENTS, PROCESSES FOR THE PREPARATION THEREOF, AND THEIR USE IN MAKING STEREO-DEFINED ORGANOPHOSHOROUS (V) COMPOUNDS PPIP5K2, NUDT1, NT5C3B HINT1 220/4885ADORA3 652/4885NT5E 42/4885

“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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