SCHEMBL684609

SCHEMBL684609

Cc1cc(Cl)c(O)c(/C=N/NC(=O)c2ccc([N+](=O)[O-])cc2)c1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 11/20 0.58
MEN1 O00255 5/20 0.58
KMT2A Q03164 5/20 0.58
KDM4E B2RXH2 5/20 0.58
TDP1 Q9NUW8 3/20 0.58
ALDH1A1 P00352 3/20 0.58
LMNA P02545 2/20 0.58
SMN1; SMN2 Q16637 4/20 0.56
NPC1 O15118 4/20 0.56
HTT P42858 3/20 0.56
MITF O75030 1/20 0.56
RAB9A P51151 1/20 0.54
PHGDH O43175 1/20 0.53
L3MBTL1 Q9Y468 4/20 0.53
USP2 O75604 1/20 0.53
MCOLN3 Q8TDD5 1/20 0.53
POLB P06746 2/20 0.53
BLM P54132 1/20 0.53
SIRT1 Q96EB6 1/20 0.52
GAA P10253 2/20 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
SCHEMBL683745 0.89 MEN1 (0.67) MAPTMEN1KMT2AKDM4ETDP1
SCHEMBL684938 0.88 DUSP3 (0.65) MAPTMEN1KMT2AKDM4ETDP1
SCHEMBL683936 0.86 KMT2A (0.64) MAPTMEN1KMT2AKDM4ETDP1
SCHEMBL685011 0.85 RAB9A (0.61) MAPTMEN1KMT2AKDM4ETDP1
SCHEMBL683946 0.84 PHGDH (0.61) MAPTMEN1KMT2AKDM4ETDP1
SCHEMBL685678 0.84 PHGDH (0.67) MAPTMEN1KMT2AKDM4ETDP1
SCHEMBL684977 0.83 KDM4E (0.59) MAPTMEN1KMT2AKDM4ETDP1
SCHEMBL684234 0.83 MAPT (0.60) MAPTMEN1KMT2AKDM4ETDP1
SCHEMBL685299 0.83 PHGDH (0.69) MAPTMEN1KMT2AKDM4ETDP1
SCHEMBL684641 0.81 MAPT (0.58) MAPTMEN1KMT2AKDM4ETDP1

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-20120148682-A1 FUNGICIDAL COMPOSITIONS INCLUDING HYDRAZONE DERIVATIVES AND COPPER DOW AGROSCIENCES LLC (US) 2012-06-14 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-20120148682-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.