SCHEMBL685052

SCHEMBL685052

COc1ccc(C(=O)N/N=C/c2cc(Cl)cc(Cl)c2O)c(O)c1

nearest known ligand 0.74

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIK3CG P48736 4/20 0.74
KDM4E B2RXH2 6/20 0.56
NPC1 O15118 3/20 0.56
MEN1 O00255 3/20 0.56
KMT2A Q03164 3/20 0.56
L3MBTL1 Q9Y468 2/20 0.56
TDP1 Q9NUW8 2/20 0.56
USP2 O75604 1/20 0.56
MCOLN3 Q8TDD5 1/20 0.56
KDM1A O60341 1/20 0.52
GAA P10253 3/20 0.49
ALDH1A1 P00352 1/20 0.49
MGAM O43451 2/20 0.48
SI P14410 2/20 0.48
MGAM2 Q2M2H8 2/20 0.48
SIRT1 Q96EB6 1/20 0.47
MAPT P10636 3/20 0.46
ATM Q13315 1/20 0.46
PSMD14 O00487 1/20 0.46
DUSP3 P51452 1/20 0.46

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
SCHEMBL684825 0.91 PIK3CG (0.64) PIK3CGKDM4ENPC1MEN1KMT2A
SCHEMBL685087 0.86 PIK3CG (0.80) PIK3CGKDM4ENPC1MEN1KMT2A
SCHEMBL683742 0.85 KMT2A (0.69) PIK3CGKDM4ENPC1MEN1KMT2A
SCHEMBL683923 0.85 PIK3CG (1.00) PIK3CGKDM4ENPC1MEN1KMT2A
SCHEMBL684872 0.82 NPC1 (0.61) PIK3CGKDM4ENPC1MEN1KMT2A
SCHEMBL1638169 0.82 MGAM (0.63) PIK3CGKDM4ENPC1MEN1KMT2A
SCHEMBL12766807 0.82 MGAM (0.63) PIK3CGKDM4ENPC1MEN1KMT2A
SCHEMBL1638171 0.82 MGAM (0.63) PIK3CGKDM4ENPC1MEN1KMT2A
SCHEMBL12767360 0.82 PIK3CG (0.69) PIK3CGKDM4ENPC1MEN1KMT2A
SCHEMBL1637369 0.82 PIK3CG (0.69) PIK3CGKDM4ENPC1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8461078-B2 Fungicidal compositions including hydrazone derivatives and copper DOW AGROSCIENCES LLC (US) 2013-06-11 US disclosed
US-8461078-B2 Fungicidal compositions including hydrazone derivatives and copper DOW AGROSCIENCES LLC (US) 2013-06-11 US disclosed
US-20120107416-A1 FUNGICIDAL COMPOSITIONS INCLUDING HYDRAZONE DERIVATIVES AND COPPER DOW AGROSCIENCES LLC (US) 2012-05-03 US disclosed
US-20120107416-A1 FUNGICIDAL COMPOSITIONS INCLUDING HYDRAZONE DERIVATIVES AND COPPER DOW AGROSCIENCES LLC (US) 2012-05-03 US disclosed
US-20120010075-A1 SYNERGISTIC FUNGICIDAL COMPOSITIONS INCLUDING HYDRAZONE DERIVATIVES AND COPPER DOW AGROSCIENCES LLC (US) 2012-01-12 US disclosed
US-20120010075-A1 SYNERGISTIC FUNGICIDAL COMPOSITIONS INCLUDING HYDRAZONE DERIVATIVES AND COPPER DOW AGROSCIENCES LLC (US) 2012-01-12 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 (2 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-20120010075-A1 SYNERGISTIC FUNGICIDAL COMPOSITIONS INCLUDING HYDRAZONE DERIVATIVES AND COPPER SOD1, CYP51A1, SOD3 PIK3CG 2876/4885KDM4E 1473/4885NPC1 1690/4885
US-20120107416-A1 FUNGICIDAL COMPOSITIONS INCLUDING HYDRAZONE DERIVATIVES AND COPPER SOD1, CYP51A1, CYP4Z1 PIK3CG 2911/4885KDM4E 1286/4885NPC1 1052/4885

“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.