SCHEMBL686354

SCHEMBL686354

O=C(N/N=C/c1cc(C(F)(F)F)ccc1O)c1ccc(Cl)cc1

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 1/20 0.69
KDM4E B2RXH2 6/20 0.66
KMT2A Q03164 6/20 0.66
MEN1 O00255 5/20 0.66
LMNA P02545 5/20 0.66
RAB9A P51151 4/20 0.66
HTT P42858 4/20 0.66
SMN1; SMN2 Q16637 3/20 0.66
POLB P06746 2/20 0.66
PSMD14 O00487 1/20 0.66
MMP2 P08253 1/20 0.66
BLM P54132 1/20 0.66
PHGDH O43175 1/20 0.65
NPC1 O15118 2/20 0.62
MITF O75030 2/20 0.62
GPR174 Q9BXC1 1/20 0.62
L3MBTL1 Q9Y468 1/20 0.62
PTBP1 P26599 1/20 0.60
TDP1 Q9NUW8 1/20 0.60
SIRT1 Q96EB6 2/20 0.57

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
SCHEMBL684540 0.93 KDM1A (0.77) KDM1AKDM4EKMT2AMEN1LMNA
SCHEMBL686241 0.90 PHGDH (0.67) KDM1AKDM4EKMT2AMEN1LMNA
SCHEMBL686554 0.88 KDM1A (0.69) KDM1AKDM4EKMT2AMEN1LMNA
SCHEMBL686261 0.88 PHGDH (0.65) KDM1AKDM4EKMT2AMEN1LMNA
SCHEMBL686258 0.87 LMNA (0.73) KDM1AKDM4EKMT2AMEN1LMNA
SCHEMBL683818 0.87 KDM1A (0.89) KDM1AKDM4EKMT2AMEN1LMNA
SCHEMBL6568342 0.87 KDM1A (0.89) KDM1AKDM4EKMT2AMEN1LMNA
SCHEMBL6568344 0.87 KDM1A (0.89) KDM1AKDM4EKMT2AMEN1LMNA
SCHEMBL6569011 0.86 KMT2A (0.75) KDM1AKDM4EKMT2AMEN1LMNA
SCHEMBL6569004 0.86 KMT2A (0.75) KDM1AKDM4EKMT2AMEN1LMNA

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 KDM1A 484/4885KDM4E 1473/4885KMT2A 1362/4885
US-20120148682-A1 FUNGICIDAL COMPOSITIONS INCLUDING HYDRAZONE DERIVATIVES AND COPPER SOD1, CYP51A1, CYP4Z1 KDM1A 291/4885KDM4E 1286/4885KMT2A 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.