SCHEMBL684657

SCHEMBL684657

O=C(N/N=C/c1cc(Cl)cc(Br)c1O)c1ccccc1C(F)(F)F

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 7/20 0.56
MEN1 O00255 6/20 0.56
MAPT P10636 5/20 0.56
KDM4E B2RXH2 5/20 0.56
HTT P42858 3/20 0.56
SIRT1 Q96EB6 7/20 0.56
FTO Q9C0B1 1/20 0.50
LMNA P02545 4/20 0.48
SMN1; SMN2 Q16637 2/20 0.48
ALOX12 P18054 1/20 0.48
NPC1 O15118 3/20 0.48
PKM P14618 2/20 0.48
RAB9A P51151 1/20 0.48
ATM Q13315 1/20 0.48
PIK3CG P48736 2/20 0.47
ALOX5 P09917 1/20 0.46
PTGS2 P35354 1/20 0.46
GAA P10253 1/20 0.45
L3MBTL1 Q9Y468 2/20 0.44
TDP1 Q9NUW8 2/20 0.44

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
SCHEMBL685291 0.90 KMT2A (0.51) KMT2AMEN1MAPTKDM4EHTT
SCHEMBL685152 0.89 PIK3CG (0.59) KMT2AMEN1MAPTKDM4EHTT
SCHEMBL684550 0.86 KMT2A (0.74) KMT2AMEN1MAPTKDM4EHTT
SCHEMBL684826 0.85 KMT2A (0.60) KMT2AMEN1MAPTKDM4EHTT
SCHEMBL1638608 0.85 KMT2A (0.65) KMT2AMEN1MAPTKDM4EHTT
SCHEMBL1638610 0.85 KMT2A (0.65) KMT2AMEN1MAPTKDM4EHTT
SCHEMBL684620 0.85 KMT2A (0.65) KMT2AMEN1MAPTKDM4EHTT
SCHEMBL684554 0.85 KMT2A (0.65) KMT2AMEN1MAPTKDM4EHTT
SCHEMBL684524 0.83 KMT2A (0.60) KMT2AMEN1MAPTKDM4EHTT
SCHEMBL685002 0.83 KMT2A (0.69) KMT2AMEN1MAPTKDM4EHTT

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 536/4885MAPT 1491/4885
US-20120107416-A1 FUNGICIDAL COMPOSITIONS INCLUDING HYDRAZONE DERIVATIVES AND COPPER SOD1, CYP51A1, CYP4Z1 KMT2A 1224/4885MEN1 508/4885MAPT 921/4885

“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.