SCHEMBL1466955

SCHEMBL1466955

COC(=O)c1cc(C2=NOC(c3cc(Cl)cc(Cl)c3)(C(F)(F)F)C2)ccc1COC(C)=O

nearest known ligand 0.34

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 2/20 0.34
PYGL P06737 1/20 0.34
PDK2 Q15119 2/20 0.33
F2 P00734 2/20 0.33
F10 P00742 2/20 0.33
PRSS1 P07477 2/20 0.33
KDM4E B2RXH2 1/20 0.33
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
MRGPRX4 Q96LA9 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
SCHEMBL1466563 0.93 NOTUM (0.34) NOTUMPYGLPDK2F2F10
SCHEMBL3457366 0.91 NOTUM (0.37) NOTUMPYGLCA1CA2
SCHEMBL1466504 0.89 PDK2 (0.34) NOTUMPDK2F2F10PRSS1
SCHEMBL1858890 0.88 NOTUM (0.39) NOTUMPYGLCA1CA2
SCHEMBL738385 0.88 NOTUM (0.36) NOTUMPYGLCA1CA2
SCHEMBL1801804 0.85 PDK2 (0.34) NOTUMPDK2F2F10PRSS1
SCHEMBL14956129 0.85 NOTUM (0.36) NOTUMPYGLCA1CA2
SCHEMBL13692112 0.85 NOTUM (0.36) NOTUMPYGLF2F10PRSS1
SCHEMBL1799389 0.85 NPC1 (0.36) NOTUMPDK2F2F10PRSS1
SCHEMBL1468195 0.85 KDM4E (0.37) NOTUMPDK2F2F10PRSS1

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-20110071141-A1 Pesticidial Condensed-Ring Aryl Compounds BAYER CROPSCIENCE AG 2011-03-24 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-20110071141-A1 Pesticidial Condensed-Ring Aryl Compounds DDT, PRDX4, CYP4X1 NOTUM 1692/4885PYGL 2575/4885PDK2 629/4885

“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.