SCHEMBL685299

SCHEMBL685299

Cc1ccc(O)c(/C=N/NC(=O)c2ccc([N+](=O)[O-])cc2)c1

nearest known ligand 0.76

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PHGDH O43175 2/20 0.69
MAPT P10636 12/20 0.68
KDM4E B2RXH2 7/20 0.68
TDP1 Q9NUW8 4/20 0.68
ALDH1A1 P00352 3/20 0.68
L3MBTL1 Q9Y468 1/20 0.68
MEN1 O00255 6/20 0.63
KMT2A Q03164 6/20 0.63
POLB P06746 1/20 0.63
LMNA P02545 3/20 0.61
SMN1; SMN2 Q16637 4/20 0.61
HTT P42858 4/20 0.61
NPC1 O15118 2/20 0.60
RAB9A P51151 1/20 0.60
DUSP3 P51452 1/20 0.57
PTPN5 P54829 1/20 0.57
PTPN11 Q06124 1/20 0.57
MITF O75030 1/20 0.56

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
SCHEMBL21292753 0.93 PHGDH (0.76) PHGDHMAPTKDM4ETDP1ALDH1A1
SCHEMBL21292751 0.93 PHGDH (0.76) PHGDHMAPTKDM4ETDP1ALDH1A1
SCHEMBL21292769 0.90 PHGDH (0.82) PHGDHMAPTKDM4ETDP1ALDH1A1
SCHEMBL21292771 0.90 PHGDH (0.82) PHGDHMAPTKDM4ETDP1ALDH1A1
SCHEMBL684813 0.87 DUSP3 (0.76) PHGDHMAPTKDM4ETDP1ALDH1A1
SCHEMBL685060 0.87 MAPT (0.72) MAPTKDM4ETDP1L3MBTL1MEN1
SCHEMBL684833 0.86 KDM1A (0.73) PHGDHMAPTKDM4ETDP1ALDH1A1
SCHEMBL21292819 0.85 PHGDH (0.79) PHGDHMAPTKDM4ETDP1ALDH1A1
SCHEMBL16035055 0.85 PHGDH (0.79) PHGDHMAPTKDM4ETDP1ALDH1A1
SCHEMBL21292702 0.85 DUSP3 (0.69) PHGDHMAPTKDM4ETDP1ALDH1A1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120148682-A1 FUNGICIDAL COMPOSITIONS INCLUDING HYDRAZONE DERIVATIVES AND COPPER DOW AGROSCIENCES LLC (US) 2012-06-14 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 PHGDH 1735/4885MAPT 1491/4885KDM4E 1473/4885
US-20120148682-A1 FUNGICIDAL COMPOSITIONS INCLUDING HYDRAZONE DERIVATIVES AND COPPER SOD1, CYP51A1, CYP4Z1 PHGDH 1393/4885MAPT 921/4885KDM4E 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.