SCHEMBL25367493

SCHEMBL25367493

Cc1nc(-c2ccc(C=O)cc2)cc2c1nc(-c1ccc(S(C)(=O)=O)cc1)n2C

nearest known ligand 0.42

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ PTGS2 P35354 9/20 0.42
▸ CA1 P00915 2/20 0.39
▸ CA2 P00918 2/20 0.39
▸ CA12 O43570 1/20 0.39
▸ CA9 Q16790 1/20 0.39
▸ HDAC6 Q9UBN7 1/20 0.37
▸ PTGS1 P23219 3/20 0.37
▸ ACSS2 Q9NR19 1/20 0.36
▸ GRM2 Q14416 1/20 0.36
▸ SYK P43405 2/20 0.36

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
SCHEMBL30425565 0.84 PTGS2 (0.44) PTGS2CA1CA2CA12CA9
SCHEMBL24266365 0.84 PTGS2 (0.44) PTGS2CA1CA2CA12CA9
SCHEMBL26072706 0.81 PTGS2 (0.37) PTGS2HDAC6PTGS1GRM2SYK
SCHEMBL31576225 0.81 PTGS2 (0.37) PTGS2HDAC6PTGS1GRM2SYK
SCHEMBL25362338 0.79 JAK2 (0.44) PTGS2CA1CA2CA12CA9
SCHEMBL25365825 0.79 PIM1 (0.42) PTGS2PTGS1SYK
SCHEMBL26072789 0.78 PTGS2 (0.42) PTGS2PTGS1SYK
SCHEMBL31578493 0.78 PTGS2 (0.48) PTGS2CA1CA2CA12CA9
SCHEMBL25368562 0.78 PTGS2 (0.48) PTGS2CA1CA2CA12CA9
SCHEMBL25364475 0.78 PLAT (0.40) PTGS2SYK

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
US-20250163054-A1 SUBSTITUTED BICYCLIC HETEROARYL COMPOUNDS USEFUL AS INHIBITORS OF TLR9 BRISTOL-MYERS SQUIBB COMPANY (US) 2025-05-22 — — US disclosed
EP-4479407-A1 SUBSTITUTED BICYCLIC HETEROARYL COMPOUNDS USEFUL AS INHIBITORS OF TLR9 Bristol-Myers Squibb Company (US) 2024-12-25 — — EP disclosed
WO-2023159153-A1 SUBSTITUTED BICYCLIC HETEROARYL COMPOUNDS USEFUL AS INHIBITORS OF TLR9 BRISTOL-MYERS SQUIBB COMPANY (US) 2023-08-24 — — 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 (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-20250163054-A1 SUBSTITUTED BICYCLIC HETEROARYL COMPOUNDS USEFUL AS INHIBITORS OF TLR9 TLR9, TLR3, TLR1 PTGS2 957/4885CA1 4809/4885CA2 3514/4885

“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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