SCHEMBL5529220

SCHEMBL5529220

C/C(=N\NC(N)=S)c1cccc(Oc2ccccc2)c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.68
METTL3 Q86U44 1/20 0.68
CTSL P07711 1/20 0.62
ALDH1A1 P00352 1/20 0.56
CTSK P43235 1/20 0.53

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
SCHEMBL5529222 1.00 ATM (0.68) ATMMETTL3CTSLALDH1A1CTSK
SCHEMBL5531911 0.87 METTL3 (0.73) ATMMETTL3CTSK
SCHEMBL5531907 0.87 METTL3 (0.73) ATMMETTL3CTSK
SCHEMBL940532 0.86 ALDH1A1 (0.67) ATMMETTL3CTSLALDH1A1CTSK
Phenyl(Methyl)Thiosemicarbazone SCHEMBL14436799 0.82 METTL3 (1.00) ATMMETTL3ALDH1A1CTSK
Acetophenone-Thiosemicarbazone SCHEMBL17666972 0.82 METTL3 (1.00) ATMMETTL3ALDH1A1CTSK
Phenyl(Methyl)Thiosemicarbazone SCHEMBL757506 0.82 METTL3 (1.00) ATMMETTL3ALDH1A1CTSK
SCHEMBL5526647 0.81 ATM (0.73) ATMMETTL3CTSLALDH1A1CTSK
SCHEMBL5526650 0.81 ATM (0.73) ATMMETTL3CTSLALDH1A1CTSK
SCHEMBL5516796 0.79 ATM (0.69) ATMMETTL3CTSLALDH1A1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070197495-A1 ANTI-PARASITIC COMPOUNDS AND METHODS OF THEIR USE THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2007-08-23 US disclosed
EP-1734939-A1 ANTI-PARASITIC COMPOUNDS AND METHODS OF THEIR USE The Regents of The University of California (US) 2006-12-27 EP disclosed
WO-2005087211-A1 ANTI-PARASITIC COMPOUNDS AND METHODS OF THEIR USE THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2005-09-22 WO 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-20070197495-A1 ANTI-PARASITIC COMPOUNDS AND METHODS OF THEIR USE CYP51A1, TUBA3C, PIGO ATM 4843/4885METTL3 4301/4885CTSL 5/4885

“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.