SCHEMBL685189

SCHEMBL685189

CC/C(=N\NC(=O)c1ccccc1)c1ccccc1O

nearest known ligand 0.68

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
GSTA1 P08263 1/20 0.68
MAPT P10636 5/20 0.65
KDM4E B2RXH2 5/20 0.65
HTT P42858 1/20 0.65
ALDH1A1 P00352 3/20 0.61
SMN1; SMN2 Q16637 7/20 0.58
RAB9A P51151 5/20 0.58
LMNA P02545 1/20 0.58
KDM1A O60341 2/20 0.57
GAA P10253 3/20 0.54
NPC1 O15118 4/20 0.53
CTDSP1 Q9GZU7 1/20 0.53
KMT2A Q03164 4/20 0.52
MEN1 O00255 3/20 0.51
GLA P06280 2/20 0.51
L3MBTL1 Q9Y468 1/20 0.51
MAPK1 P28482 1/20 0.51

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
SCHEMBL12387934 0.87 MAPT (0.60) GSTA1MAPTKDM4EHTTALDH1A1
SCHEMBL684479 0.85 MAPT (0.52) GSTA1MAPTKDM4EHTTALDH1A1
SCHEMBL684545 0.82 SMN1; SMN2 (0.65) MAPTKDM4EHTTALDH1A1SMN1; SMN2
SCHEMBL684658 0.81 KDM1A (0.83) GSTA1MAPTKDM4EHTTALDH1A1
SCHEMBL422880 0.81 GSTA1 (1.00) GSTA1MAPTKDM4EHTTALDH1A1
SCHEMBL12387849 0.81 KDM4E (0.64) MAPTKDM4EHTTALDH1A1SMN1; SMN2
SCHEMBL684544 0.80 KDM4E (0.59) GSTA1MAPTKDM4EHTTALDH1A1
SCHEMBL19283309 0.78 KDM1A (0.57) GSTA1MAPTKDM4EHTTALDH1A1
SCHEMBL19283310 0.78 KDM1A (0.57) GSTA1MAPTKDM4EHTTALDH1A1
SCHEMBL684538 0.78 MAPT (0.56) MAPTKDM4EHTTALDH1A1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 (1 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 GSTA1 784/4885MAPT 1491/4885KDM4E 1473/4885

“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.