SCHEMBL13697803

SCHEMBL13697803

COc1c(N=O)c(C(=O)O)cc2nc(C(F)(F)F)ccc12

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 10/20 0.41
TUBB4A P04350 1/20 0.36
TUBB P07437 1/20 0.36
TUBA3C P0DPH7 1/20 0.36
TUBA1B P68363 1/20 0.36
TUBA4A P68366 1/20 0.36
TUBB4B P68371 1/20 0.36
TUBB3 Q13509 1/20 0.36
TUBB2A Q13885 1/20 0.36
TUBB8 Q3ZCM7 1/20 0.36
TUBA3E Q6PEY2 1/20 0.36
TUBA1A Q71U36 1/20 0.36
TUBA1C Q9BQE3 1/20 0.36
TUBB6 Q9BUF5 1/20 0.36
TUBB2B Q9BVA1 1/20 0.36
TUBB1 Q9H4B7 1/20 0.36
HSD17B10 Q99714 2/20 0.36
PDE4A P27815 6/20 0.36
PDE4C Q08493 6/20 0.36
PDE4D Q08499 6/20 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
SCHEMBL2936513 0.83 PDE4B (0.41) PDE4BTUBB4ATUBBTUBA3CTUBA1B
SCHEMBL2935943 0.80 PKM (0.51) PDE4BHSD17B10PDE4APDE4CPDE4D
SCHEMBL2938117 0.72 TUBB4A (0.42) PDE4BTUBB4ATUBBTUBA3CTUBA1B
SCHEMBL535644 0.71 GABRP (0.39) PDE4BHSD17B10KDM4EALDH1A1HPGD
SCHEMBL13697644 0.69 NT5E (0.38) PDE4BHSD17B10KDM4EALDH1A1HPGD
SCHEMBL13697639 0.69 NT5E (0.38) HSD17B10KDM4EALDH1A1HPGDNT5E
SCHEMBL535729 0.68 IGF1R (0.39) PDE4BALDH1A1POLBSORT1IGF1R
SCHEMBL3541953 0.68 POLB (0.60) PDE4BTUBB4ATUBBTUBA3CTUBA1B
SCHEMBL30640906 0.68 POLB (0.60) PDE4BTUBB4ATUBBTUBA3CTUBA1B
SCHEMBL28226031 0.68 TAS2R14 (0.51) PDE4BKDM4EALDH1A1HPGD

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-20090221587-A1 NOVEL INSECTICIDES SYNGENTA CROP PROTECTION, INC. (US) 2009-09-03 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-20090221587-A1 NOVEL INSECTICIDES DDT, CYP4F11, ACHE PDE4B 1031/4885TUBB4A 365/4885TUBB 194/4885

“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.