SCHEMBL684544

SCHEMBL684544

CC/C(=N\NC(=O)c1c(Cl)cccc1Cl)c1ccccc1O

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 6/20 0.59
MAPT P10636 4/20 0.59
HTT P42858 2/20 0.59
SMN1; SMN2 Q16637 6/20 0.56
ATM Q13315 1/20 0.56
GAA P10253 5/20 0.49
MEN1 O00255 3/20 0.48
KMT2A Q03164 3/20 0.48
GLA P06280 1/20 0.48
NPC1 O15118 2/20 0.46
RAB9A P51151 2/20 0.46
ALDH1A1 P00352 1/20 0.46
POLB P06746 1/20 0.46
PKM P14618 1/20 0.46
LMNA P02545 2/20 0.44
HPGD P15428 2/20 0.44
MAPK1 P28482 1/20 0.44
GSTA1 P08263 1/20 0.43
KDM1A O60341 1/20 0.43
RECQL P46063 1/20 0.43

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
SCHEMBL684545 0.89 SMN1; SMN2 (0.65) KDM4EMAPTHTTSMN1; SMN2ATM
SCHEMBL684856 0.83 GAA (0.50) KDM4EMAPTHTTSMN1; SMN2ATM
SCHEMBL685189 0.80 GSTA1 (0.68) KDM4EMAPTHTTSMN1; SMN2GAA
SCHEMBL12387934 0.77 MAPT (0.60) KDM4EMAPTHTTSMN1; SMN2GAA
SCHEMBL684538 0.74 MAPT (0.56) KDM4EMAPTHTTSMN1; SMN2GAA
SCHEMBL6448938 0.73 POLB (0.61) KDM4EHTTSMN1; SMN2GAAMEN1
SCHEMBL684479 0.73 MAPT (0.52) KDM4EMAPTHTTSMN1; SMN2MEN1
SCHEMBL685146 0.72 SMN1; SMN2 (0.57) KDM4EMAPTHTTSMN1; SMN2ATM
SCHEMBL684651 0.71 KDM1A (0.65) KDM4EMAPTSMN1; SMN2GAAMEN1
SCHEMBL684699 0.71 KDM1A (0.57) KDM4EMAPTHTTSMN1; SMN2GAA

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-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 (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 KDM4E 1473/4885MAPT 1491/4885HTT 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.