SCHEMBL685326

SCHEMBL685326

COc1ccc(C(=O)N/N=C(\C)c2ccc(OC)cc2O)cc1

nearest known ligand 0.62

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.61
NPC1 O15118 7/20 0.61
ALDH1A1 P00352 5/20 0.61
SMN1; SMN2 Q16637 5/20 0.61
KDM4E B2RXH2 4/20 0.61
HTT P42858 1/20 0.61
GAA P10253 3/20 0.60
L3MBTL1 Q9Y468 1/20 0.60
KDM1A O60341 1/20 0.59
CYP1A2 P05177 1/20 0.59
MAPK1 P28482 2/20 0.55
HPGD P15428 2/20 0.55
CYP3A4 P08684 1/20 0.55
RAB9A P51151 7/20 0.54
MTOR P42345 1/20 0.54
PSMD14 O00487 1/20 0.53
POLB P06746 1/20 0.52
APEX1 P27695 1/20 0.52
TDP1 Q9NUW8 1/20 0.52

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
SCHEMBL684993 0.94 MAPT (0.61) MAPTNPC1ALDH1A1SMN1; SMN2KDM4E
SCHEMBL685329 0.92 MAPT (0.57) MAPTNPC1ALDH1A1SMN1; SMN2KDM4E
SCHEMBL685250 0.92 MAPT (0.57) MAPTNPC1ALDH1A1SMN1; SMN2KDM4E
SCHEMBL684675 0.92 L3MBTL1 (0.63) MAPTNPC1ALDH1A1SMN1; SMN2KDM4E
SCHEMBL684021 0.90 MAPT (0.56) MAPTNPC1ALDH1A1SMN1; SMN2KDM4E
SCHEMBL685030 0.90 KDM1A (0.59) MAPTNPC1ALDH1A1SMN1; SMN2KDM4E
SCHEMBL12387926 0.89 MAPT (0.59) MAPTNPC1ALDH1A1SMN1; SMN2KDM4E
SCHEMBL683824 0.86 KDM1A (0.75) MAPTNPC1ALDH1A1SMN1; SMN2KDM4E
SCHEMBL22815483 0.86 ALDH1A1 (0.61) MAPTNPC1ALDH1A1SMN1; SMN2KDM4E
SCHEMBL684681 0.85 L3MBTL1 (0.64) MAPTNPC1ALDH1A1SMN1; SMN2KDM4E

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 MAPT 1491/4885NPC1 1690/4885ALDH1A1 127/4885

“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.