SCHEMBL684975

SCHEMBL684975

O=C(N/N=C/c1cc(Cl)cc(Cl)c1O)c1cccc(OC(F)(F)F)c1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.58
NPC1 O15118 3/20 0.58
KDM4E B2RXH2 3/20 0.58
TDP1 Q9NUW8 3/20 0.58
MEN1 O00255 3/20 0.58
USP2 O75604 1/20 0.58
MCOLN3 Q8TDD5 1/20 0.58
L3MBTL1 Q9Y468 1/20 0.58
MAPT P10636 7/20 0.52
SMN1; SMN2 Q16637 3/20 0.52
RAB9A P51151 2/20 0.52
CYP1A2 P05177 1/20 0.52
CYP3A4 P08684 1/20 0.52
CYP2D6 P10635 1/20 0.52
CYP2C9 P11712 1/20 0.52
CYP2C19 P33261 1/20 0.52
GCGR P47871 4/20 0.50
PIK3CG P48736 1/20 0.50
HTT P42858 4/20 0.49
KDM1A O60341 2/20 0.49

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
SCHEMBL678880 1.00 KMT2A (0.58) KMT2ANPC1KDM4ETDP1MEN1
SCHEMBL685179 0.88 KDM4E (0.65) KMT2ANPC1KDM4ETDP1MEN1
SCHEMBL684872 0.86 NPC1 (0.61) KMT2ANPC1KDM4ETDP1MEN1
SCHEMBL685144 0.85 MEN1 (0.60) KMT2ANPC1KDM4ETDP1MEN1
SCHEMBL683833 0.84 KDM4E (0.67) KMT2ANPC1KDM4ETDP1MEN1
SCHEMBL684499 0.83 LMNA (0.60) KMT2ANPC1KDM4ETDP1MEN1
SCHEMBL685159 0.83 NPC1 (0.70) KMT2ANPC1KDM4ETDP1MEN1
SCHEMBL685173 0.82 NPC1 (0.74) KMT2ANPC1KDM4ETDP1MEN1
SCHEMBL6570260 0.81 NPC1 (0.77) KMT2ANPC1KDM4ETDP1MEN1
SCHEMBL685119 0.81 NPC1 (0.77) KMT2ANPC1KDM4ETDP1MEN1

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 8 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
WO-2010083322-A2 FUNGICIDAL COMPOSITIONS INCLUDING HYDRAZONE DERIVATIVES AND COPPER DOW AGROSCIENCES LLC (US) 2010-07-22 WO disclosed
WO-2010083307-A2 SYNERGISTIC FUNGICIDAL COMPOSITIONS INCLUDING HYDRAZONE DERIVATIVES AND COPPER DOW AGROSCIENCES LLC (US) 2010-07-22 WO 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 1362/4885NPC1 1690/4885KDM4E 1473/4885
US-20120107416-A1 FUNGICIDAL COMPOSITIONS INCLUDING HYDRAZONE DERIVATIVES AND COPPER SOD1, CYP51A1, CYP4Z1 KMT2A 1224/4885NPC1 1052/4885KDM4E 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.