SCHEMBL684586

SCHEMBL684586

COc1ccc(O)c(/C(C)=N/NC(=O)c2ccccc2Cl)c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 1/20 0.55
MAPT P10636 3/20 0.53
GAA P10253 3/20 0.53
TDP1 Q9NUW8 2/20 0.53
POLB P06746 1/20 0.53
APEX1 P27695 1/20 0.53
MEN1 O00255 3/20 0.52
KMT2A Q03164 3/20 0.52
AGTR1 P30556 1/20 0.52
OPRK1 P41145 1/20 0.52
KDM4E B2RXH2 4/20 0.51
RAB9A P51151 4/20 0.51
ALDH1A1 P00352 3/20 0.50
NPC1 O15118 2/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
CYP3A4 P08684 1/20 0.50
CLK1 P49759 1/20 0.49
PKM P14618 1/20 0.48
FADS1 O60427 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.48

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
SCHEMBL683879 0.91 MAPT (0.65) KDM1AMAPTGAATDP1POLB
SCHEMBL683849 0.87 RAB9A (0.62) KDM1AMAPTGAATDP1MEN1
SCHEMBL685112 0.85 KDM1A (0.74) KDM1AMAPTGAAPOLBMEN1
SCHEMBL683929 0.84 KDM4E (0.60) KDM1AMAPTGAATDP1POLB
SCHEMBL683846 0.84 KDM1A (0.69) KDM1AMAPTGAATDP1MEN1
SCHEMBL684651 0.83 KDM1A (0.65) KDM1AMAPTGAAPOLBMEN1
SCHEMBL684693 0.83 KMT2A (0.61) KDM1AMAPTGAAMEN1KMT2A
SCHEMBL683856 0.82 KDM1A (0.66) KDM1AMAPTGAATDP1POLB
SCHEMBL685084 0.81 HPGD (0.62) KDM1AMAPTGAATDP1POLB
SCHEMBL685090 0.81 KDM1A (0.50) KDM1AMAPTGAATDP1POLB

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 KDM1A 484/4885MAPT 1491/4885GAA 670/4885

“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.