SCHEMBL684478

SCHEMBL684478

O=C(N/N=C/c1cc(Cl)cc(Cl)c1O)c1c(Cl)cccc1Cl

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 6/20 0.65
MEN1 O00255 5/20 0.65
KDM4E B2RXH2 5/20 0.65
NPC1 O15118 3/20 0.65
TDP1 Q9NUW8 2/20 0.65
USP2 O75604 1/20 0.65
MCOLN3 Q8TDD5 1/20 0.65
L3MBTL1 Q9Y468 1/20 0.65
PIK3CG P48736 1/20 0.61
KDM1A O60341 3/20 0.59
MAPT P10636 5/20 0.55
CD38 P28907 1/20 0.49
POLB P06746 1/20 0.49
RAB9A P51151 4/20 0.48
SMN1; SMN2 Q16637 3/20 0.48
GCGR P47871 1/20 0.48
CYP1A2 P05177 1/20 0.48
CYP3A4 P08684 1/20 0.48
CYP2D6 P10635 1/20 0.48
CYP2C9 P11712 1/20 0.48

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
SCHEMBL685177 0.85 PIK3CG (0.67) KMT2AMEN1KDM4ENPC1TDP1
SCHEMBL684823 0.85 KDM1A (0.64) KMT2AMEN1KDM4ENPC1TDP1
SCHEMBL685159 0.84 NPC1 (0.70) KMT2AMEN1KDM4ENPC1TDP1
SCHEMBL685119 0.84 NPC1 (0.77) KMT2AMEN1KDM4ENPC1TDP1
SCHEMBL6570259 0.84 NPC1 (0.77) KMT2AMEN1KDM4ENPC1TDP1
SCHEMBL6570260 0.84 NPC1 (0.77) KMT2AMEN1KDM4ENPC1TDP1
SCHEMBL684862 0.82 KDM4E (0.79) KMT2AMEN1KDM4ENPC1TDP1
SCHEMBL684778 0.82 KDM4E (0.74) KMT2AMEN1KDM4ENPC1TDP1
SCHEMBL1639165 0.82 PIK3CG (0.72) KMT2AMEN1KDM4ENPC1TDP1
SCHEMBL1639164 0.82 PIK3CG (0.72) KMT2AMEN1KDM4ENPC1TDP1

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 KMT2A 1362/4885MEN1 536/4885KDM4E 1473/4885
US-20120107416-A1 FUNGICIDAL COMPOSITIONS INCLUDING HYDRAZONE DERIVATIVES AND COPPER SOD1, CYP51A1, CYP4Z1 KMT2A 1224/4885MEN1 508/4885KDM4E 1286/4885

“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.