SCHEMBL684611

SCHEMBL684611

C=CCc1cccc(/C=N/NC(=O)c2ccccc2)c1O

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 11/20 0.71
KMT2A Q03164 11/20 0.71
HTT P42858 11/20 0.71
MAPT P10636 10/20 0.71
KDM4E B2RXH2 9/20 0.71
SMN1; SMN2 Q16637 9/20 0.71
LMNA P02545 7/20 0.68
ALOX12 P18054 1/20 0.68
RAB9A P51151 2/20 0.64
NPC1 O15118 2/20 0.64
TDP1 Q9NUW8 3/20 0.60
CASP3 P42574 1/20 0.60
RECQL P46063 1/20 0.60
CASP7 P55210 1/20 0.60
MAPK1 P28482 1/20 0.60
MTOR P42345 1/20 0.60
ALDH1A1 P00352 1/20 0.59
NPSR1 Q6W5P4 1/20 0.57
TP53 P04637 1/20 0.54
PKM P14618 1/20 0.54

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
SCHEMBL1638694 0.89 HTT (0.64) MEN1KMT2AHTTMAPTKDM4E
SCHEMBL1638697 0.89 HTT (0.64) MEN1KMT2AHTTMAPTKDM4E
SCHEMBL10031205 0.89 KMT2A (0.73) MEN1KMT2AHTTMAPTKDM4E
SCHEMBL21082988 0.83 MEN1 (0.65) MEN1KMT2AHTTMAPTKDM4E
SCHEMBL17067838 0.83 MEN1 (0.65) MEN1KMT2AHTTMAPTKDM4E
SCHEMBL21082987 0.83 MEN1 (0.65) MEN1KMT2AHTTMAPTKDM4E
SCHEMBL13978688 0.82 MEN1 (0.65) MEN1KMT2AHTTMAPTKDM4E
SCHEMBL9458183 0.81 KMT2A (0.62) MEN1KMT2AHTTMAPTKDM4E
SCHEMBL12388017 0.81 KDM4E (0.74) MEN1KMT2AHTTMAPTKDM4E
SCHEMBL13978689 0.81 MEN1 (0.63) MEN1KMT2AHTTMAPTKDM4E

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 MEN1 536/4885KMT2A 1362/4885HTT 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.