SCHEMBL14980248

SCHEMBL14980248

Nc1nc2c(ncn2[C@@H]2O[C@@H]3COP(=O)(O)OC4[C@@H](COP(=O)(O)OC3[C@@H]2O)O[C@@H](n2cnc3c(=O)[nH]c(N)nc32)[C@H]4O)c(=O)[nH]1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
STING1 Q86WV6 18/20 1.00
PDE3B Q13370 1/20 1.00
PDE3A Q14432 1/20 1.00

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
SCHEMBL12671632 1.00 STING1 (1.00) STING1PDE3BPDE3A
SCHEMBL17974376 1.00 STING1 (1.00) STING1PDE3BPDE3A
SCHEMBL12634565 1.00 STING1 (1.00) STING1PDE3BPDE3A
SCHEMBL17325408 1.00 STING1 (1.00) STING1PDE3BPDE3A
SCHEMBL12634582 1.00 STING1 (1.00) STING1PDE3BPDE3A
SCHEMBL18737202 1.00 STING1 (1.00) STING1PDE3BPDE3A
SCHEMBL24467522 1.00 STING1 (1.00) STING1PDE3BPDE3A
SCHEMBL738 1.00 STING1 (1.00) STING1PDE3BPDE3A
SCHEMBL21470181 1.00 STING1 (1.00) STING1PDE3BPDE3A
SCHEMBL21498373 1.00 STING1 (1.00) STING1PDE3BPDE3A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9695212-B2 Compositions comprising cyclic purine dinucleotides having defined stereochemistries and methods for their preparation and use Aduro Biotech, Inc. (US) 2017-07-04 US disclosed
US-20170158772-A1 COMPOSITIONS OF ANTIBODY CONSTRUCT - AGONIST CONJUGATES AND METHODS OF USE THEREOF OPI VI - IP HOLDCO LLC 2017-06-08 US disclosed
US-20170101432-A1 CRYSTALLINE 3',5'-CYCLIC DIGUANYLIC ACID YAMASA CORPORATION (JP) 2017-04-13 US disclosed
US-20140205653-A1 COMPOSITIONS COMPRISING CYCLIC PURINE DINUCLEOTIDES HAVING DEFINED STEREOCHEMISTRIES AND METHODS FOR THEIR PREPARATION AND USE Aduro Biotech, Inc. (US) 2014-07-24 US disclosed
US-8450293-B2 Synthesis and characterization of C8 analogs of c-di-GMP RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY (US) 2013-05-28 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 (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-20170158772-A1 COMPOSITIONS OF ANTIBODY CONSTRUCT - AGONIST CONJUGATES AND METHODS OF USE THEREOF FCGR1A, CD40, CD40LG STING1 287/4885PDE3B 1447/4885PDE3A 1461/4885
US-20170101432-A1 CRYSTALLINE 3',5'-CYCLIC DIGUANYLIC ACID GDA, NT5C3B, CA3 STING1 1708/4885PDE3B 241/4885PDE3A 90/4885

“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.