SCHEMBL12464348

SCHEMBL12464348

CN=S(C)(=O)Cc1ccc(C(F)(F)F)nc1

nearest known ligand 0.40

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
DAO P14920 3/20 0.40
TRPV4 Q9HBA0 1/20 0.40
KCNH2 Q12809 3/20 0.39
MAP4K4 O95819 1/20 0.39
PIK3CA P42336 1/20 0.39
MINK1 Q8N4C8 1/20 0.39
PI4KB Q9UBF8 1/20 0.39
NR1H2 P55055 7/20 0.37
NR1H3 Q13133 7/20 0.37
NAMPT P43490 1/20 0.37
TKT P29401 1/20 0.36
KDM1A O60341 1/20 0.36
MAOA P21397 1/20 0.36
MAOB P27338 1/20 0.36
CYP2C9 P11712 1/20 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

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
SCHEMBL21300042 0.90 KCNH2 (0.33) DAOKCNH2MAP4K4PIK3CAMINK1
SCHEMBL12464108 0.85 DAO (0.44) DAOTRPV4KCNH2MAP4K4PIK3CA
SCHEMBL16622004 0.83 DAO (0.37) DAOTRPV4KCNH2MAP4K4PIK3CA
SCHEMBL119494 0.83 CDK2 (0.39) DAOTRPV4KCNH2MAP4K4PIK3CA
SCHEMBL13373481 0.81 DAO (0.45) DAOTRPV4KCNH2MAP4K4PIK3CA
SCHEMBL12797513 0.81 DAO (0.42) DAOTRPV4KCNH2MAP4K4PIK3CA
SCHEMBL1480608 0.81 KCNH2 (0.40) DAOTRPV4KCNH2MAP4K4PIK3CA
SCHEMBL4939057 0.80 KCNH2 (0.39) DAOTRPV4KCNH2MAP4K4PIK3CA
SCHEMBL1480522 0.80 KCNH2 (0.39) DAOTRPV4KCNH2MAP4K4PIK3CA
SCHEMBL12079598 0.79 NAMPT (0.36) DAOKCNH2MAP4K4PIK3CAMINK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1989184-B1 INSECTICIDAL N-SUBSTITUTED (6-HALOALKYLPYRIDIN-3-YL)ALKYL SULFOXIMINES DOW AGROSCIENCES LLC (US) 2011-07-06 EP disclosed
US-7960354-B2 Synergistic pesticidal mixtures DOW AGROSCIENCES LLC (US) 2011-06-14 US disclosed
EP-2057120-B1 INSECTICIDAL N-SUBSTITUTED (HETEROARYL)CYCLOALKYL SULFOXIMINES DOW AGROSCIENCES LLC (US) 2010-05-05 EP disclosed
WO-2010022897-A2 METHOD FOR IMPROVING PLANT GROWTH BAYER CROPSCIENCE AG (DE) 2010-03-04 WO disclosed
US-20090325892-A1 Synergistic pesticidal mixtures DOW AGROSCIENCES LLC (US) 2009-12-31 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-20090325892-A1 Synergistic pesticidal mixtures ACHE, DDT, PDE1C DAO 2015/4885TRPV4 792/4885KCNH2 1424/4885

“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.