SCHEMBL21636992

SCHEMBL21636992

Nc1ncnc2c1ncn2[C@H]1CC[C@@H](CO[P@@](=O)(O)S)O1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.53
P2RY1 P47900 5/20 0.52
P2RY2 P41231 3/20 0.52
SRC P12931 2/20 0.52
SMN1; SMN2 Q16637 2/20 0.52
DNPH1 O43598 1/20 0.52
PRKAB2 O43741 1/20 0.52
TRPM2 O94759 1/20 0.52
LDHA P00338 1/20 0.52
ADRB2 P07550 1/20 0.52
FBP1 P09467 1/20 0.52
ADORA1 P30542 1/20 0.52
PRKAG1 P54619 1/20 0.52
PRKAA2 P54646 1/20 0.52
PDE4D Q08499 1/20 0.52
KCNH2 Q12809 1/20 0.52
PRKAA1 Q13131 1/20 0.52
PDE3A Q14432 1/20 0.52
TAS1R3 Q7RTX0 1/20 0.52
TAS1R1 Q7RTX1 1/20 0.52

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
SCHEMBL20028990 1.00 POLB (0.53) POLBP2RY1P2RY2SRCSMN1; SMN2
SCHEMBL22352087 1.00 POLB (0.53) POLBP2RY1P2RY2SRCSMN1; SMN2
SCHEMBL22352200 1.00 POLB (0.53) POLBP2RY1P2RY2SRCSMN1; SMN2
SCHEMBL16221579 1.00 POLB (0.53) POLBP2RY1P2RY2SRCSMN1; SMN2
SCHEMBL16410913 1.00 POLB (0.53) POLBP2RY1P2RY2SRCSMN1; SMN2
SCHEMBL20225019 0.92 P2RY1 (0.62) POLBP2RY1P2RY2SRCSMN1; SMN2
SCHEMBL20959779 0.92 P2RY1 (0.62) POLBP2RY1P2RY2SRCSMN1; SMN2
SCHEMBL18837728 0.92 P2RY1 (0.62) POLBP2RY1P2RY2SRCSMN1; SMN2
SCHEMBL20225051 0.92 P2RY1 (0.62) POLBP2RY1P2RY2SRCSMN1; SMN2
SCHEMBL285262 0.92 P2RY1 (0.62) POLBP2RY1P2RY2SRCSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3854799-B1 CYCLIC DINUCLEOTIDE ANALOGUE, PHARMACEUTICAL COMPOSITION THEREOF, AND APPLICATION SHANGHAI DE NOVO PHARMATECH CO LTD (CN) 2024-07-17 EP disclosed
US-20240026353-A1 COMPOUNDS AND METHODS FOR MODULATING SCN2A IONIS PHARMACEUTICALS, INC. 2024-01-25 US disclosed
US-11667663-B2 Cyclic dinucleotides as anticancer agents BRISTOL-MYERS SQUIBB COMPANY (US) 2023-06-06 US disclosed
US-20220204973-A1 Antisense Oligonucleotide for Targeting Progranulin HOFFMANN LA ROCHE (US) 2022-06-30 US disclosed
WO-2022127914-A1 NUCLEOSIDE-THIODIPHOSPHATE-HEPTOSE COMPOUNDS FOR TREATING CONDITIONS ASSOCIATED WITH ALPK1 ACTIVITY PYROTECH (BEIJING) BIOTECHNOLOGY CO., LTD. (CN) 2022-06-23 WO disclosed
WO-2022097117-A1 ANTIBODY DRUG CONJUGATES TAKEDA PHARMACEUTICAL COMPANY LTD. (JP) 2022-05-12 WO disclosed
US-20220111028-A1 Combination Of A STING Agonist And A Complex Comprising A Cell Penetrating Peptide, A Cargo And A TLR Peptide Agonist BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2022-04-14 US disclosed
US-20210353760-A1 PRO-CYCLIC DINUCLEOTIDES AND PRO-CYCLIC DINUCLEOTIDE CONJUGATES FOR CYTOKINE INDUCTION INVIVOGEN (FR) 2021-11-18 US disclosed
WO-2021178818-A2 THERAPEUTIC AGENTS AND CONJUGATES THEREOF BEIJING XUANYI PHARMASCIENCES CO., LTD. (CN) 2021-09-10 WO disclosed
US-20210002323-A1 CYCLIC DINUCLEOTIDES AS ANTICANCER AGENTS BRISTOL MYERS SQUIBB CO (US) 2021-01-07 US disclosed
WO-2018118665-A1 CYCLIC DINUCLEOTIDE STING AGONISTS FOR CANCER TREATMENT MERCK SHARP & DOHME CORP. (US) 2018-06-28 WO disclosed
WO-2018100558-A2 CYCLIC DINUCLEOTIDE TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2018-06-07 WO disclosed
US-20180092937-A1 CYCLIC DINUCLEOTIDE COMPOUNDS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2018-04-05 US disclosed
WO-2017053722-A1 MODULATORS OF KRAS EXPRESSION IONIS PHARMACEUTICALS, INC. (US) 2017-03-30 WO disclosed
WO-2016168592-A2 COMPOSITIONS FOR MODULATING C9ORF72 EXPRESSION IONIS PHARMACEUTICALS, INC. (US) 2016-10-20 WO disclosed
WO-2015168635-A2 COMPOSITIONS AND METHODS FOR MODULATING COMPLEMENT FACTOR B EXPRESSION ISIS PHARMACEUTICALS, INC. (US) 2015-11-05 WO disclosed
WO-2015168618-A2 COMPOSITIONS AND METHODS FOR MODULATING GROWTH HORMONE RECEPTOR EXPRESSION ISIS PHARMACEUTICALS, INC. (US) 2015-11-05 WO disclosed
WO-2015153800-A2 COMPOSITIONS FOR MODULATING SOD-1 EXPRESSION ISIS PHARMACEUTICALS, INC. (US) 2015-10-08 WO disclosed
WO-2015100394-A1 MODULATION OF ANGIOPOIETIN-LIKE 3 EXPRESSION ISIS PHARMACEUTICALS, INC. (US) 2015-07-02 WO disclosed
WO-2014179627-A2 COMPOSITIONS AND METHODS FOR MODULATING HBV AND TTR EXPRESSION ISIS PHARMACEUTICALS, INC. (US) 2014-11-06 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 (6 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-20240026353-A1 COMPOUNDS AND METHODS FOR MODULATING SCN2A SCN2A, SCN1A, SCN1B POLB 3256/4885P2RY1 2640/4885P2RY2 1316/4885
US-20220111028-A1 Combination Of A STING Agonist And A Complex Comprising A Cell Penetrating Peptide, A Cargo And A TLR Peptide Agonist STING1, TLR9, TLR3 POLB 3088/4885P2RY1 50/4885P2RY2 108/4885
US-20210353760-A1 PRO-CYCLIC DINUCLEOTIDES AND PRO-CYCLIC DINUCLEOTIDE CONJUGATES FOR CYTOKINE INDUCTION STING1, CGAS, TLR9 POLB 857/4885P2RY1 61/4885P2RY2 89/4885
US-11667663-B2 Cyclic dinucleotides as anticancer agents DPYD, NTPCR, DUT POLB 40/4885P2RY1 904/4885P2RY2 1143/4885
US-20210002323-A1 CYCLIC DINUCLEOTIDES AS ANTICANCER AGENTS DPYD, CD38, NTPCR POLB 40/4885P2RY1 762/4885P2RY2 985/4885
US-20180092937-A1 CYCLIC DINUCLEOTIDE COMPOUNDS STING1, CGAS, IRF3 POLB 345/4885P2RY1 15/4885P2RY2 46/4885

“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.