SCHEMBL685351

SCHEMBL685351

COc1ccc(C(=O)N/N=C(\C)c2cc(Br)ccc2O)cc1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.55
CYP1A2 P05177 3/20 0.54
MAPT P10636 2/20 0.54
KDM1A O60341 2/20 0.53
NPC1 O15118 4/20 0.52
RAB9A P51151 4/20 0.52
MEN1 O00255 3/20 0.52
KMT2A Q03164 3/20 0.52
SMN1; SMN2 Q16637 3/20 0.52
MAOA P21397 1/20 0.52
MAOB P27338 1/20 0.52
OPRK1 P41145 1/20 0.51
CYP3A4 P08684 2/20 0.50
CYP2C19 P33261 2/20 0.50
NFKB1 P19838 1/20 0.50
CASP3 P42574 1/20 0.50
NFKB2 Q00653 1/20 0.50
RELA Q04206 1/20 0.50
SENP7 Q9BQF6 1/20 0.50
SENP6 Q9GZR1 1/20 0.50

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
SCHEMBL685062 0.90 RAB9A (0.61) GAACYP1A2KDM1ANPC1RAB9A
SCHEMBL685128 0.86 GAA (0.56) GAACYP1A2MAPTKDM1ANPC1
SCHEMBL684690 0.86 KDM1A (0.56) GAACYP1A2MAPTKDM1ANPC1
SCHEMBL685329 0.85 MAPT (0.57) GAACYP1A2MAPTKDM1ANPC1
SCHEMBL684840 0.85 KDM1A (0.73) GAACYP1A2MAPTKDM1ANPC1
SCHEMBL683907 0.85 KDM1A (0.69) GAACYP1A2MAPTKDM1ANPC1
SCHEMBL13568924 0.85 KDM1A (0.55) GAACYP1A2MAPTKDM1ANPC1
SCHEMBL684684 0.85 KDM1A (0.72) GAACYP1A2MAPTKDM1ANPC1
SCHEMBL684717 0.84 GAA (0.54) GAACYP1A2MAPTNPC1RAB9A
SCHEMBL684584 0.84 KDM1A (0.54) GAACYP1A2MAPTKDM1ANPC1

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-8476194-B2 Fungicidal compositions including hydrazone derivatives and copper DOW AGROSCIENCES, LLC (US) 2013-07-02 US disclosed
US-8476194-B2 Fungicidal compositions including hydrazone derivatives and copper DOW AGROSCIENCES, LLC (US) 2013-07-02 US disclosed
US-20120021066-A1 FUNGICIDAL COMPOSITIONS INCLUDING HYDRAZONE DERIVATIVES AND COPPER DOW AGROSCIENCES LLC (US) 2012-01-26 US disclosed
US-20120021066-A1 FUNGICIDAL COMPOSITIONS INCLUDING HYDRAZONE DERIVATIVES AND COPPER DOW AGROSCIENCES LLC (US) 2012-01-26 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 GAA 670/4885CYP1A2 11/4885MAPT 1491/4885
US-20120021066-A1 FUNGICIDAL COMPOSITIONS INCLUDING HYDRAZONE DERIVATIVES AND COPPER SOD1, CYP51A1, CYP4Z1 GAA 386/4885CYP1A2 12/4885MAPT 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.