SCHEMBL22734119

SCHEMBL22734119

CCCCNc1nc(Cl)nc2c1[S+]([O-])CC2

nearest known ligand 0.37

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ TLR8 Q9NR97 9/20 0.37
▸ KDM4E B2RXH2 2/20 0.37
▸ L3MBTL1 Q9Y468 2/20 0.37
▸ NPSR1 Q6W5P4 1/20 0.37
▸ KMT2A Q03164 1/20 0.34
▸ TLR7 Q9NYK1 5/20 0.33
▸ ALDH1A1 P00352 1/20 0.32
▸ HPGD P15428 1/20 0.32
▸ SLC29A1 Q99808 2/20 0.32
▸ HDAC1 Q13547 1/20 0.30
▸ HDAC2 Q92769 1/20 0.30

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
SCHEMBL22734117 0.92 KMT2A (0.34) KMT2A
SCHEMBL22734113 0.86 LMNA (0.37) —
SCHEMBL22734112 0.80 ESR1 (0.40) —
SCHEMBL22734103 0.76 GLP1R (0.33) ALDH1A1
SCHEMBL22734102 0.76 GLP1R (0.33) ALDH1A1
SCHEMBL22734107 0.76 GLP1R (0.33) ALDH1A1
SCHEMBL22734106 0.74 GAA (0.37) —
SCHEMBL21074841 0.74 LMNA (0.37) —
SCHEMBL23084551 0.73 — —
SCHEMBL19559985 0.73 KCNH2 (0.39) TLR8TLR7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3724195-B1 SUBSTITUTED TETRAHYDROPYRAN DIHYDROTHIENOPYRIMIDINES AND THEIR USE AS PHOSPHODIESTERASE INHIBITORS UNION THERAPEUTICS AS (DK) 2023-12-27 — — EP disclosed
US-11299497-B2 Substituted tetrahydropyran dihydrothienopyrimidines and their use as phosphodiesterase inhibitors UNION therapeutics A/S (DK) 2022-04-12 — — US disclosed
US-20200385400-A1 SUBSTITUTED TETRAHYDROPYRAN DIHYDROTHIENOPYRIMIDINES AND THEIR USE AS PHOSPHODIESTERASE INHIBITORS UNION therapeutics A/S (DK) 2020-12-10 — — 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-11299497-B2 Substituted tetrahydropyran dihydrothienopyrimidines and their use as phosphodiesterase inhibitors PDE5A, PDE4A, PDE7A TLR8 3434/4885KDM4E 1916/4885L3MBTL1 3934/4885
US-20200385400-A1 SUBSTITUTED TETRAHYDROPYRAN DIHYDROTHIENOPYRIMIDINES AND THEIR USE AS PHOSPHODIESTERASE INHIBITORS PDE5A, PDE4A, PDE7A TLR8 3434/4885KDM4E 1916/4885L3MBTL1 3934/4885

“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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