SCHEMBL16622003

SCHEMBL16622003

C#CN=S(C)(=O)C(C)c1ccc(C(F)(F)F)nc1

nearest known ligand 0.36

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ KCNH2 Q12809 3/20 0.36
▸ MAP4K4 O95819 1/20 0.36
▸ PIK3CA P42336 1/20 0.36
▸ MINK1 Q8N4C8 1/20 0.36
▸ PI4KB Q9UBF8 1/20 0.36
▸ P2RX7 Q99572 9/20 0.36
▸ TRPV4 Q9HBA0 1/20 0.36
▸ CYP2C9 P11712 2/20 0.35
▸ SLC22A6 Q4U2R8 1/20 0.35
▸ SLC22A8 Q8TCC7 1/20 0.35
▸ SLC22A12 Q96S37 1/20 0.35
▸ SLC22A11 Q9NSA0 1/20 0.35
▸ HSD11B1 P28845 1/20 0.34
▸ LGMN Q99538 1/20 0.34
▸ PDE2A O00408 1/20 0.32
▸ GPR139 Q6DWJ6 1/20 0.32
▸ PTGS1 P23219 1/20 0.32
▸ PTGS2 P35354 1/20 0.32
▸ NR1I2 O75469 1/20 0.32

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
Sulfoxaflor SCHEMBL18103859 0.88 LGMN (0.37) KCNH2MAP4K4PIK3CAMINK1PI4KB
Sulfoxaflor SCHEMBL17184067 0.88 LGMN (0.37) KCNH2MAP4K4PIK3CAMINK1PI4KB
Sulfoxaflor SCHEMBL230364 0.88 LGMN (0.37) KCNH2MAP4K4PIK3CAMINK1PI4KB
Sulfoxaflor SCHEMBL14148160 0.88 LGMN (0.37) KCNH2MAP4K4PIK3CAMINK1PI4KB
Sulfoxaflor SCHEMBL520711 0.88 LGMN (0.37) KCNH2MAP4K4PIK3CAMINK1PI4KB
Sulfoxaflor SCHEMBL686361 0.88 LGMN (0.37) KCNH2MAP4K4PIK3CAMINK1PI4KB
Sulfoxaflor SCHEMBL29688368 0.88 LGMN (0.37) KCNH2MAP4K4PIK3CAMINK1PI4KB
Sulfoxaflor SCHEMBL18103858 0.88 LGMN (0.37) KCNH2MAP4K4PIK3CAMINK1PI4KB
SCHEMBL13335207 0.85 KCNH2 (0.39) KCNH2MAP4K4PIK3CAMINK1PI4KB
SCHEMBL12349893 0.85 KCNH2 (0.39) KCNH2MAP4K4PIK3CAMINK1PI4KB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170071203-A1 Active compound combinations having insecticidal properties BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2017-03-16 — — US disclosed
US-9000180-B2 Processes for the production of N-substituted sulfoximine pyridine N-oxides DOW AGROSCIENCES LLC (US) 2015-04-07 — — 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-20170071203-A1 Active compound combinations having insecticidal properties ACHE, BCHE, DDT KCNH2 2608/4885MAP4K4 3650/4885PIK3CA 3217/4885

“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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