SCHEMBL684717

SCHEMBL684717

COc1ccc(C(=O)N/N=C(\C)c2cc(Br)cc(Br)c2O)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.54
MAPT P10636 6/20 0.53
CYP1A2 P05177 2/20 0.53
RAB9A P51151 7/20 0.49
NPC1 O15118 7/20 0.49
SMN1; SMN2 Q16637 5/20 0.49
ALDH1A1 P00352 2/20 0.48
PSMD14 O00487 1/20 0.48
HPGD P15428 1/20 0.48
MAOA P21397 1/20 0.48
MAOB P27338 1/20 0.48
KDM4E B2RXH2 2/20 0.48
ASF1A Q9Y294 1/20 0.47
HTT P42858 1/20 0.47
MEN1 O00255 1/20 0.46
CYP3A4 P08684 1/20 0.46
NFKB1 P19838 1/20 0.46
CYP2C19 P33261 1/20 0.46
CASP3 P42574 1/20 0.46
NFKB2 Q00653 1/20 0.46

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
SCHEMBL685357 0.89 MEN1 (0.58) MAPTCYP1A2RAB9ANPC1SMN1; SMN2
SCHEMBL684863 0.86 SIRT1 (0.52) GAAMAPTCYP1A2RAB9ANPC1
SCHEMBL684714 0.85 MEN1 (0.54) CYP1A2RAB9ANPC1SMN1; SMN2MEN1
SCHEMBL684860 0.85 RAB9A (0.67) MAPTCYP1A2RAB9ANPC1SMN1; SMN2
SCHEMBL685351 0.84 GAA (0.55) GAAMAPTCYP1A2RAB9ANPC1
SCHEMBL685141 0.83 MTOR (0.61) MAPTCYP1A2RAB9ANPC1SMN1; SMN2
SCHEMBL14195175 0.81 MAPT (0.61) GAAMAPTRAB9ANPC1SMN1; SMN2
SCHEMBL685329 0.80 MAPT (0.57) GAAMAPTCYP1A2RAB9ANPC1
SCHEMBL685326 0.79 MAPT (0.61) GAAMAPTCYP1A2RAB9ANPC1
SCHEMBL685373 0.79 MAPT (0.56) GAAMAPTCYP1A2RAB9ANPC1

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 5 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

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 670/4885MAPT 1491/4885CYP1A2 11/4885
US-20120021066-A1 FUNGICIDAL COMPOSITIONS INCLUDING HYDRAZONE DERIVATIVES AND COPPER SOD1, CYP51A1, CYP4Z1 GAA 386/4885MAPT 921/4885CYP1A2 12/4885

“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.