SCHEMBL685094

SCHEMBL685094

COc1ccc(/C(C)=N/NC(=O)c2cccc(Cl)c2)c(O)c1OC

nearest known ligand 0.54

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 6/20 0.51
SMN1; SMN2 Q16637 2/20 0.48
CYP1A2 P05177 1/20 0.48
CYP3A4 P08684 1/20 0.48
CYP2D6 P10635 1/20 0.48
GRM5 P41594 1/20 0.48
MEN1 O00255 3/20 0.47
KMT2A Q03164 3/20 0.47
POLB P06746 1/20 0.47
GAA P10253 1/20 0.47
CASP6 P55212 1/20 0.47
ALDH1A1 P00352 3/20 0.46
RAB9A P51151 3/20 0.46
MTOR P42345 1/20 0.46
LMNA P02545 1/20 0.46
HPGD P15428 1/20 0.46
HTT P42858 1/20 0.46
MAPT P10636 2/20 0.46
NPC1 O15118 1/20 0.45

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
SCHEMBL685255 0.89 KDM1A (0.55) KDM1ASMN1; SMN2CYP1A2CYP3A4CYP2D6
SCHEMBL684871 0.88 RAB9A (0.51) SMN1; SMN2CYP1A2MEN1KMT2AGAA
SCHEMBL685370 0.86 KDM1A (0.49) KDM1ASMN1; SMN2CYP1A2CYP3A4MEN1
SCHEMBL684727 0.86 MAPT (0.54) KDM1ASMN1; SMN2CYP1A2CYP3A4MEN1
SCHEMBL684879 0.81 MAPT (0.51) SMN1; SMN2CYP3A4MEN1KMT2AGAA
SCHEMBL685151 0.81 GAA (0.55) KDM1ASMN1; SMN2CYP1A2KMT2AGAA
SCHEMBL685150 0.81 MAPT (0.49) KDM1ASMN1; SMN2CYP1A2CYP3A4MEN1
SCHEMBL684029 0.80 KDM1A (0.58) KDM1ASMN1; SMN2CYP1A2CYP3A4CYP2D6
SCHEMBL683881 0.80 L3MBTL1 (0.63) KDM1ASMN1; SMN2CYP1A2CYP3A4CYP2D6
SCHEMBL685155 0.80 SMN1; SMN2 (0.52) KDM1ASMN1; SMN2CYP1A2CYP3A4MEN1

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 6 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
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 KDM1A 484/4885SMN1; SMN2 4107/4885CYP1A2 11/4885
US-20120021066-A1 FUNGICIDAL COMPOSITIONS INCLUDING HYDRAZONE DERIVATIVES AND COPPER SOD1, CYP51A1, CYP4Z1 KDM1A 291/4885SMN1; SMN2 3775/4885CYP1A2 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.