SCHEMBL685352

SCHEMBL685352

COc1ccc(C(=O)N/N=C(\C)c2cccc([N+](=O)[O-])c2O)cc1

nearest known ligand 0.58

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 4/20 0.58
MAPT P10636 7/20 0.53
GAA P10253 4/20 0.51
RAB9A P51151 3/20 0.51
KDM4E B2RXH2 1/20 0.51
NPC1 O15118 3/20 0.50
CYP1A2 P05177 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.49
ALDH1A1 P00352 2/20 0.49
KMT2A Q03164 2/20 0.48
MEN1 O00255 1/20 0.48
LMNA P02545 1/20 0.47
HPGD P15428 1/20 0.47
KDM1A O60341 1/20 0.47

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
SCHEMBL685246 0.87 ALDH1A1 (0.55) SMN1; SMN2MAPTGAARAB9AKDM4E
SCHEMBL684904 0.87 ALDH1A1 (0.60) SMN1; SMN2MAPTGAARAB9AKDM4E
SCHEMBL684906 0.86 ALDH1A1 (0.51) SMN1; SMN2MAPTGAARAB9ANPC1
SCHEMBL684704 0.86 MEN1 (0.54) SMN1; SMN2MAPTGAARAB9ANPC1
SCHEMBL685066 0.84 P2RX1 (0.55) SMN1; SMN2MAPTGAARAB9ANPC1
SCHEMBL684673 0.83 GAA (0.57) SMN1; SMN2MAPTGAARAB9AKDM4E
SCHEMBL684831 0.81 GAA (0.55) SMN1; SMN2MAPTGAARAB9AKDM4E
SCHEMBL683861 0.81 POLB (0.59) SMN1; SMN2MAPTGAARAB9ANPC1
SCHEMBL10197509 0.81 GAA (0.54) SMN1; SMN2MAPTGAARAB9AKDM4E
SCHEMBL684846 0.80 MEN1 (0.58) SMN1; SMN2MAPTGAARAB9AKDM4E

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-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 SMN1; SMN2 4107/4885MAPT 1491/4885GAA 670/4885
US-20120021066-A1 FUNGICIDAL COMPOSITIONS INCLUDING HYDRAZONE DERIVATIVES AND COPPER SOD1, CYP51A1, CYP4Z1 SMN1; SMN2 3775/4885MAPT 921/4885GAA 386/4885

“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.