SCHEMBL440591

SCHEMBL440591

O=c1[nH]c(=S)ccn1[C@H]1C[C@H](O)[C@@H](CO)O1

nearest known ligand 0.59

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ TK1 P04183 3/20 0.59
▸ LMNA P02545 2/20 0.59
▸ SMN1; SMN2 Q16637 2/20 0.59
▸ ALOX12 P18054 1/20 0.56
▸ ADRA1A P35348 1/20 0.56
▸ TK2 O00142 1/20 0.55
▸ CYP1A2 P05177 1/20 0.54
▸ CYP3A4 P08684 1/20 0.54
▸ TSHR P16473 1/20 0.54
▸ BLM P54132 1/20 0.54
▸ PMP22 Q01453 1/20 0.54
▸ NPSR1 Q6W5P4 1/20 0.54

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
SCHEMBL28552817 1.00 TK1 (0.59) TK1LMNASMN1; SMN2ALOX12ADRA1A
SCHEMBL440592 1.00 TK1 (0.59) TK1LMNASMN1; SMN2ALOX12ADRA1A
SCHEMBL8338549 1.00 TK1 (0.59) TK1LMNASMN1; SMN2ALOX12ADRA1A
Deoxyuridine SCHEMBL9219265 0.87 DUT (0.64) TK1LMNASMN1; SMN2ALOX12ADRA1A
Deoxyuridine SCHEMBL114598 0.87 DUT (0.64) TK1LMNASMN1; SMN2ALOX12ADRA1A
Deoxyuridine SCHEMBL24512520 0.87 DUT (0.64) TK1LMNASMN1; SMN2ALOX12ADRA1A
Deoxyuridine SCHEMBL9219261 0.87 DUT (0.64) TK1LMNASMN1; SMN2ALOX12ADRA1A
Deoxyuridine SCHEMBL28843 0.87 DUT (0.64) TK1LMNASMN1; SMN2ALOX12ADRA1A
Deoxyuridine SCHEMBL28844 0.87 DUT (0.64) TK1LMNASMN1; SMN2ALOX12ADRA1A
Deoxyuridine SCHEMBL4847464 0.87 DUT (0.64) TK1LMNASMN1; SMN2ALOX12ADRA1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4114417-A2 THERAPEUTIC AGENTS AND CONJUGATES THEREOF Beijing Xuanyi Pharmasciences Co., Ltd. (CN) 2023-01-11 — — EP claimed
CN-115427051-A Therapeutic agents and conjugates thereof 北京轩义医药科技有限公司 2022-12-02 — — CN claimed
WO-2021178818-A2 THERAPEUTIC AGENTS AND CONJUGATES THEREOF BEIJING XUANYI PHARMASCIENCES CO., LTD. (CN) 2021-09-10 — — WO claimed
US-20170145417-A1 IMMUNE REGULATORY OLIGONUCLEOTIDE (IRO) COMPOUNDS TO MODULATE TOLL-LIKE RECEPTOR BASED IMMUNE RESPONSE IDERA PHARMACEUTICALS INC (US) 2017-05-25 — — US claimed
EP-2437791-B1 POTENTIATION OF AUTOIMMUNE AND INFLAMMATORY DISEASE TREATMENTS BY IMMUNE REGULATORY OLIGONUCLEOTIDE (IRO) ANTAGONISTS OF TLR7 AND TLR9 IDERA PHARMACEUTICALS INC (US) 2017-03-22 — — EP claimed
US-9453228-B2 Immune regulatory oligonucleotide (IRO) compounds to modulate toll-like receptor based immune response IDERA PHARMACEUTICALS, INC. (US) 2016-09-27 — — US claimed
US-20160138022-A1 IMMUNE REGULATORY OLIGONUCLEOTIDE (IRO) COMPOUNDS TO MODULATE TOLL-LIKE RECEPTOR BASED IMMUNE RESPONSE NOVAQUEST CO-INVESTMENT FUND XV, L.P. 2016-05-19 — — US claimed
EP-2371834-B1 Stabilized immunomodulatory oligonucleotides IDERA PHARMACEUTICALS INC (US) 2016-02-17 — — EP claimed
US-9206430-B2 Immune regulatory oligonucleotide (IRO) compounds to modulate toll-like receptor based immune response IDERA PHARMACEUTICALS, INC. (US) 2015-12-08 — — US claimed
EP-2343307-B1 Immune regulatory oligonucleotide (IRO) compounds to modulate toll-like receptor based immune response IDERA PHARMACEUTICALS (US) 2015-08-05 — — EP claimed
EP-1278761-B1 MODULATION OF OLIGONUCLEOTIDE CpG-MEDIATED IMMUNE STIMULATION BY POSITIONAL MODIFICATION OF NUCLEOSIDES HYBRIDON INC (US) 2005-04-06 — — EP claimed
US-20050026861-A1 Stabilized immunomodulatory oligonucleotides NOVAQUEST CO-INVESTMENT FUND XV, L.P. 2005-02-03 — — US claimed
US-20050009773-A1 Using oligonucleotide immunostimulant mixture with drug HYBRIDON, INC. 2005-01-13 — — US claimed
WO-2005001055-A2 STABILIZED IMMUNOMODULATORY OLIGONUCLEOTIDES HYBRIDON, INC. (US) 2005-01-06 — — WO claimed
WO-2004103301-A2 SYNERGISTIC TREATMENT OF CANCER USING IMMUNOMERS IN CONJUNCTION WITH CHEMOTHERAPEUTIC AGENTS HYBRIDON, INC. (US) 2004-12-02 — — WO claimed
WO-2003057822-A9 MODULATION OF IMMUNOSTIMULATORY PROPERTIES OF OLIGONUCLEOTIDE-BASED COMPOUNDS BY OPTIMAL PRESENTATION OF 5' ENDS HYBRIDON INC (US) 2004-07-01 — — WO claimed
US-20040097719-A1 Modulation of immunostimulatory properties of oligonucleotide-based compounds by optimal presentation of 5' ends HYBRIDON, INC. 2004-05-20 — — US claimed
EP-1393745-A1 Modulation of immunostimulatory properties of oligonucleotide-based compounds by optimal presentation of 5'ends HYBRIDON, INC. (US) 2004-03-03 — — EP claimed
WO-2003057822-A2 MODULATION OF IMMUNOSTIMULATORY PROPERTIES OF OLIGONUCLEOTIDE-BASED COMPOUNDS BY OPTIMAL PRESENTATION OF 5' ENDS HYBRIDON, INC. (US) 2003-07-17 — — WO claimed
WO-2003035836-A2 MODULATION OF IMMUNOSTIMULATORY PROPERTIES OF OLIGONUCLEOTIDE-BASED COMPOUNDS BY OPTIMAL PRESENTATION OF 5' ENDS HYBRIDON INC. (US) 2003-05-01 — — WO claimed

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

For each of this compound's patents that has machine-readable text (5 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-20160138022-A1 IMMUNE REGULATORY OLIGONUCLEOTIDE (IRO) COMPOUNDS TO MODULATE TOLL-LIKE RECEPTOR BASED IMMUNE RESPONSE TLR3, TLR9, TLR5 TK1 2830/4885LMNA 4793/4885SMN1; SMN2 4083/4885
US-20050026861-A1 Stabilized immunomodulatory oligonucleotides IRF3, TLR9, TLR3 TK1 470/4885LMNA 3838/4885SMN1; SMN2 1464/4885
US-20050009773-A1 Using oligonucleotide immunostimulant mixture with drug TLR3, TLR9, CD47 TK1 216/4885LMNA 4781/4885SMN1; SMN2 2230/4885
US-20170145417-A1 IMMUNE REGULATORY OLIGONUCLEOTIDE (IRO) COMPOUNDS TO MODULATE TOLL-LIKE RECEPTOR BASED IMMUNE RESPONSE TLR3, TLR9, TLR5 TK1 2830/4885LMNA 4793/4885SMN1; SMN2 4083/4885
US-20040097719-A1 Modulation of immunostimulatory properties of oligonucleotide-based compounds by optimal presentation of 5' ends TLR5, TLR3, ENTPD5 TK1 306/4885LMNA 4649/4885SMN1; SMN2 937/4885

“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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