SCHEMBL11104169

SCHEMBL11104169

Oc1nc(O)c2c(n1)CCCS2

nearest known ligand 0.33

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ TNKS O95271 1/20 0.33
▸ PARP1 P09874 1/20 0.33
▸ WNT3A P56704 1/20 0.33
▸ TNKS2 Q9H2K2 1/20 0.33
▸ PARP2 Q9UGN5 1/20 0.33
▸ PDE4B Q07343 1/20 0.30
▸ PDE4D Q08499 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
SCHEMBL1827452 0.88 RAB9A (0.31) —
SCHEMBL11108193 0.81 KDM4E (0.39) TNKSPARP1WNT3ATNKS2PARP2
SCHEMBL9879229 0.77 KMT2A (0.32) —
SCHEMBL9878583 0.77 PDE4B (0.31) PDE4BPDE4D
SCHEMBL9879791 0.77 — —
SCHEMBL15661120 0.75 — —
SCHEMBL9878543 0.73 PDE4B (0.32) PDE4BPDE4D
SCHEMBL9878630 0.73 PDE4B (0.32) PDE4BPDE4D
SCHEMBL13176906 0.68 NPC1 (0.31) —
SCHEMBL1821069 0.66 ACHE (0.43) —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025092985-A1 PHOSPHODIESTERASE 4B INHIBITOR, AND PREPARATION METHOD THEREFOR AND USE THEREOF 合肥医工医药股份有限公司 2025-05-08 — — WO disclosed
CN-117247394-A Nitrogen-containing heterocycles as PDE4B inhibitors 武汉人福创新药物研发中心有限公司 2023-12-19 — — CN disclosed
US-10590145-B2 Tetrahydrothiopyranopyrimidine derivatives as anti-HIV agent SHANDONG UNIVERSITY (CN) 2020-03-17 — — US disclosed
US-10590145-B2 Tetrahydrothiopyranopyrimidine derivatives as anti-HIV agent SHANDONG UNIVERSITY (CN) 2020-03-17 — — US disclosed
US-20200031844-A1 Tetrahydrothiopyranopyrimidine derivatives as anti-HIV agent SHANDONG UNIVERSITY (CN) 2020-01-30 — — US disclosed
US-20200031844-A1 Tetrahydrothiopyranopyrimidine derivatives as anti-HIV agent SHANDONG UNIVERSITY (CN) 2020-01-30 — — US disclosed
US-4435566-A HYPOGLYCEMIA, ANTIHISTAMINE, ANTIDIABETIC ACTIVITY MARUKO SEIYAKU CO., LTD. (JP) 1984-03-06 — — 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-10590145-B2 Tetrahydrothiopyranopyrimidine derivatives as anti-HIV agent TYMP, DPYD, TPMT TNKS 622/4885PARP1 1290/4885WNT3A 4249/4885
US-20200031844-A1 Tetrahydrothiopyranopyrimidine derivatives as anti-HIV agent TYMP, DPYD, TPMT TNKS 622/4885PARP1 1290/4885WNT3A 4249/4885

“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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