SCHEMBL684865

SCHEMBL684865

O=C(N/N=C/c1cc(Cl)cc(Cl)c1O)c1ccc(C(F)(F)F)cc1

nearest known ligand 0.74

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.74
KMT2A Q03164 4/20 0.74
NPC1 O15118 4/20 0.74
MEN1 O00255 3/20 0.74
L3MBTL1 Q9Y468 2/20 0.74
TDP1 Q9NUW8 2/20 0.74
USP2 O75604 1/20 0.74
MCOLN3 Q8TDD5 1/20 0.74
SIRT1 Q96EB6 2/20 0.65
PIK3CG P48736 1/20 0.57
LMNA P02545 3/20 0.56
PHGDH O43175 1/20 0.55
KDM1A O60341 2/20 0.54
RAB9A P51151 4/20 0.52
POLB P06746 2/20 0.52
HTT P42858 2/20 0.52
SMN1; SMN2 Q16637 2/20 0.52
PSMD14 O00487 2/20 0.52
MMP2 P08253 2/20 0.52
BLM P54132 1/20 0.52

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
SCHEMBL686246 0.89 SIRT1 (0.61) KDM4EKMT2ANPC1MEN1L3MBTL1
SCHEMBL684848 0.89 NPC1 (0.75) KDM4EKMT2ANPC1MEN1L3MBTL1
SCHEMBL684862 0.89 KDM4E (0.79) KDM4EKMT2ANPC1MEN1L3MBTL1
SCHEMBL683833 0.89 KDM4E (0.67) KDM4EKMT2ANPC1MEN1L3MBTL1
SCHEMBL684624 0.88 SIRT1 (0.77) KDM4EKMT2ANPC1MEN1L3MBTL1
SCHEMBL684880 0.88 KMT2A (0.70) KDM4EKMT2ANPC1MEN1L3MBTL1
SCHEMBL6569745 0.87 KMT2A (0.63) KDM4EKMT2ANPC1MEN1L3MBTL1
SCHEMBL6569749 0.87 KMT2A (0.63) KDM4EKMT2ANPC1MEN1L3MBTL1
SCHEMBL9921127 0.87 SIRT1 (0.61) KDM4EKMT2ANPC1MEN1L3MBTL1
SCHEMBL685179 0.86 KDM4E (0.65) KDM4EKMT2ANPC1MEN1L3MBTL1

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 3 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-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

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 KDM4E 1473/4885KMT2A 1362/4885NPC1 1690/4885
US-20120107416-A1 FUNGICIDAL COMPOSITIONS INCLUDING HYDRAZONE DERIVATIVES AND COPPER SOD1, CYP51A1, CYP4Z1 KDM4E 1286/4885KMT2A 1224/4885NPC1 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.