SCHEMBL684879

SCHEMBL684879

COc1ccc(/C(C)=N/NC(=O)c2ccccc2Cl)c(O)c1OC

nearest known ligand 0.52

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.51
MEN1 O00255 3/20 0.51
KMT2A Q03164 3/20 0.51
AGTR1 P30556 1/20 0.51
OPRK1 P41145 1/20 0.51
CYP3A4 P08684 1/20 0.49
ALDH1A1 P00352 2/20 0.49
PYGL P06737 1/20 0.47
KDM4E B2RXH2 4/20 0.47
TDP1 Q9NUW8 1/20 0.47
SMN1; SMN2 Q16637 4/20 0.44
RAB9A P51151 3/20 0.44
NPC1 O15118 2/20 0.44
HTT P42858 2/20 0.44
GAA P10253 2/20 0.44
TSHR P16473 1/20 0.43
HDAC1 Q13547 1/20 0.43
HDAC8 Q9BY41 1/20 0.43
HDAC6 Q9UBN7 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
SCHEMBL684887 0.88 SMN1; SMN2 (0.56) MAPTMEN1KMT2AALDH1A1KDM4E
SCHEMBL685358 0.87 ATM (0.48) MAPTMEN1KMT2AALDH1A1KDM4E
SCHEMBL684926 0.87 CYP3A4 (0.55) MAPTMEN1KMT2AAGTR1OPRK1
SCHEMBL685096 0.86 RAB9A (0.53) MAPTMEN1KMT2AALDH1A1KDM4E
SCHEMBL684727 0.84 MAPT (0.54) MAPTMEN1KMT2ACYP3A4ALDH1A1
SCHEMBL685370 0.82 KDM1A (0.49) MAPTMEN1KMT2AAGTR1OPRK1
SCHEMBL685054 0.81 MAPT (0.61) MAPTMEN1KMT2AAGTR1OPRK1
SCHEMBL685094 0.81 KDM1A (0.51) MAPTMEN1KMT2ACYP3A4ALDH1A1
SCHEMBL685150 0.79 MAPT (0.49) MAPTMEN1KMT2ACYP3A4ALDH1A1
SCHEMBL685151 0.79 GAA (0.55) MAPTKMT2AALDH1A1KDM4ETDP1

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 MAPT 1491/4885MEN1 536/4885KMT2A 1362/4885
US-20120021066-A1 FUNGICIDAL COMPOSITIONS INCLUDING HYDRAZONE DERIVATIVES AND COPPER SOD1, CYP51A1, CYP4Z1 MAPT 921/4885MEN1 508/4885KMT2A 1224/4885

“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.