SCHEMBL24323009

SCHEMBL24323009

C=C[C@@H]1[C@@H]2OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c4ncn4ccnc54)[C@H](O)[C@@H]3OP(=O)(O)OC[C@H]2O[C@H]1n1cnc2c1ncn1ccnc21

nearest known ligand 0.58

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ STING1 Q86WV6 8/20 0.58
▸ PDE4A P27815 8/20 0.58
▸ PDE4B Q07343 8/20 0.58
▸ PDE4C Q08493 8/20 0.58
▸ PDE4D Q08499 8/20 0.58
▸ LMNA P02545 2/20 0.58
▸ GMNN O75496 1/20 0.58
▸ RAPGEF3 O95398 1/20 0.58
▸ BLM P54132 1/20 0.58
▸ KMT2A Q03164 1/20 0.58
▸ NPSR1 Q6W5P4 1/20 0.58
▸ RAPGEF4 Q8WZA2 1/20 0.58
▸ PDE3B Q13370 1/20 0.53
▸ PDE3A Q14432 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
SCHEMBL20908833 0.92 STING1 (0.67) STING1PDE4APDE4BPDE4CPDE4D
SCHEMBL20908500 0.86 STING1 (0.59) STING1PDE4APDE4BPDE4CPDE4D
SCHEMBL24323072 0.85 STING1 (0.72) STING1PDE3BPDE3A
SCHEMBL24322083 0.85 STING1 (0.71) STING1LMNAGMNNRAPGEF3BLM
SCHEMBL20908476 0.84 STING1 (0.82) STING1PDE3BPDE3A
SCHEMBL20547873 0.82 STING1 (0.77) STING1LMNAGMNNRAPGEF3BLM
SCHEMBL24323065 0.81 STING1 (0.76) STING1LMNAGMNNRAPGEF3BLM
SCHEMBL25691261 0.81 STING1 (0.76) STING1LMNAGMNNRAPGEF3BLM
SCHEMBL20908440 0.80 STING1 (0.72) STING1LMNAGMNNRAPGEF3BLM
SCHEMBL24687500 0.79 STING1 (0.78) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220117995-A1 CYCLIC DINUCLEOTIDES AS ANTICANCER AGENTS BRISTOL MYERS SQUIBB CO (US) 2022-04-21 — — 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 (1 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-20220117995-A1 CYCLIC DINUCLEOTIDES AS ANTICANCER AGENTS DPYD, CD38, DUT STING1 159/4885PDE4A 160/4885PDE4B 156/4885

“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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