SCHEMBL22838097

SCHEMBL22838097

Cc1ccc([S+]([O-])n2cc(-c3ncc(C)c(N)n3)c3cc(Cl)cnc32)cc1

nearest known ligand 0.32

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ CYP2C9 P11712 1/20 0.32
▸ PKMYT1 Q99640 1/20 0.32
▸ MAP3K14 Q99558 1/20 0.31

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
SCHEMBL24059784 0.90 — —
SCHEMBL18051888 0.81 PIM1 (0.39) —
SCHEMBL18629226 0.81 DCK (0.31) —
SCHEMBL21014903 0.72 NPC1 (0.31) —
SCHEMBL10304064 0.69 PTPN11 (0.42) —
SCHEMBL18902127 0.67 JAK2 (0.35) —
SCHEMBL19937783 0.67 ALDH1A1 (0.38) —
SCHEMBL18629001 0.65 PDK1 (0.38) —
SCHEMBL24059785 0.64 — —
SCHEMBL21014901 0.64 JAK2 (0.50) MAP3K14

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-10874673-B2 Inhibitors of influenza viruses replication VERTEX PHARMACEUTICALS INCORPORATED (US) 2020-12-29 — — 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-10874673-B2 Inhibitors of influenza viruses replication ACE, IRF3, ACE2 CYP2C9 1426/4885PKMYT1 2975/4885MAP3K14 1718/4885

“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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