SCHEMBL1982234

SCHEMBL1982234

CSC(=S)NN=Cc1ccccn1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CTH P32929 11/20 1.00
TOP2A P11388 2/20 0.67
MEN1 O00255 1/20 0.60
ALDH1A1 P00352 1/20 0.60
LMNA P02545 1/20 0.60
KMT2A Q03164 1/20 0.60
ADORA2A P29274 1/20 0.58
SLC2A1 P11166 1/20 0.57
L3MBTL1 Q9Y468 1/20 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
SCHEMBL1982233 1.00 CTH (1.00) CTHTOP2AMEN1ALDH1A1LMNA
SCHEMBL31690655 0.82 TOP2A (0.82) CTHTOP2AMEN1ALDH1A1LMNA
SCHEMBL13611503 0.80 TOP2A (1.00) CTHTOP2AMEN1ALDH1A1LMNA
SCHEMBL293101 0.80 TOP2A (0.68) CTHTOP2AMEN1LMNAKMT2A
SCHEMBL2562207 0.80 TOP2A (0.68) CTHTOP2AMEN1ALDH1A1LMNA
SCHEMBL534248 0.80 TOP2A (0.68) CTHTOP2AMEN1LMNAKMT2A
SCHEMBL2562208 0.80 TOP2A (0.68) CTHTOP2AMEN1ALDH1A1LMNA
SCHEMBL31690665 0.77 TOP2A (0.73) CTHTOP2AMEN1ALDH1A1LMNA
SCHEMBL3059864 0.77 NPC1 (0.68) CTHTOP2AMEN1ALDH1A1LMNA
SCHEMBL5180987 0.77 TOP2A (1.00) CTHTOP2AMEN1LMNAKMT2A

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-20120309798-A1 Tumour Treatment Agents and Method VIVOLUX AB 2012-12-06 US disclosed
EP-2512473-A1 TUMOUR TREATMENT AGENTS AND METHOD Vivolux Ab (SE) 2012-10-24 EP disclosed
WO-2011075032-A1 TUMOUR TREATMENT AGENTS AND METHOD VIVOLUX AB (SE) 2011-06-23 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-20120309798-A1 Tumour Treatment Agents and Method PMS2, PDCD1, TK2 CTH 876/4885TOP2A 5/4885MEN1 96/4885

“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.