SCHEMBL16013302

SCHEMBL16013302

CSc1ncnc2sc(C(=O)N(C)CC(=O)N(C)C)nc12

nearest known ligand 0.52

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
MKNK1 Q9BUB5 16/20 0.52
NOTUM Q6P988 2/20 0.39
RECQL P46063 1/20 0.34
ALDH1A1 P00352 1/20 0.33
LMNA P02545 1/20 0.33

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
SCHEMBL16013394 0.88 MKNK1 (0.53) MKNK1NOTUMRECQL
SCHEMBL16012996 0.86 MKNK1 (0.46) MKNK1NOTUMALDH1A1LMNA
SCHEMBL16013357 0.82 MKNK1 (0.51) MKNK1NOTUM
SCHEMBL5458654 0.76 ALDH1A1 (0.41) NOTUMALDH1A1LMNA
SCHEMBL5067504 0.75 ALDH1A1 (0.40) MKNK1NOTUMALDH1A1LMNA
SCHEMBL5464890 0.73 ALDH1A1 (0.42) MKNK1NOTUMALDH1A1LMNA
SCHEMBL16371212 0.71 MKNK1 (0.81) MKNK1
SCHEMBL20505765 0.71 MKNK2 (0.56) MKNK1ALDH1A1
SCHEMBL16013025 0.71 MKNK1 (0.52) MKNK1NOTUM
SCHEMBL5068984 0.71 MKNK2 (0.42) MKNK1ALDH1A1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9675612-B2 Substituted thiazolopyrimidines BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2017-06-13 US disclosed
US-9675612-B2 Substituted thiazolopyrimidines BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2017-06-13 US disclosed
US-9675612-B2 Substituted thiazolopyrimidines BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2017-06-13 US disclosed
US-20160159789-A1 SUBSTITUTED PYRAZOLOPYRIDINES BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2016-06-09 US disclosed
US-20160159789-A1 SUBSTITUTED PYRAZOLOPYRIDINES BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2016-06-09 US disclosed
US-20160159789-A1 SUBSTITUTED PYRAZOLOPYRIDINES BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2016-06-09 US disclosed
EP-3019505-A1 SUBSTITUTED PYRAZOLO-PYRIDINAMINES Bayer Pharma Aktiengesellschaft (DE) 2016-05-18 EP disclosed
US-20160009734-A1 SUBSTITUTED THIAZOLOPYRIMIDINES BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2016-01-14 US disclosed
US-20160009734-A1 SUBSTITUTED THIAZOLOPYRIMIDINES BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2016-01-14 US disclosed
US-20160009734-A1 SUBSTITUTED THIAZOLOPYRIMIDINES BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2016-01-14 US disclosed
EP-2964656-A1 SUBSTITUTED THIAZOLOPYRIMIDINES Bayer Pharma Aktiengesellschaft (DE) 2016-01-13 EP disclosed
WO-2015004024-A1 SUBSTITUTED PYRAZOLO-PYRIDINAMINES BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2015-01-15 WO disclosed
WO-2015004024-A1 SUBSTITUTED PYRAZOLO-PYRIDINAMINES BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2015-01-15 WO disclosed
WO-2014135480-A1 SUBSTITUTED THIAZOLOPYRIMIDINES BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2014-09-12 WO disclosed
WO-2014135480-A1 SUBSTITUTED THIAZOLOPYRIMIDINES BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2014-09-12 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 (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-20160009734-A1 SUBSTITUTED THIAZOLOPYRIMIDINES DPYD, TYMP, THPO MKNK1 3409/4885NOTUM 1268/4885RECQL 218/4885
US-20160159789-A1 SUBSTITUTED PYRAZOLOPYRIDINES DPYD, PGF, VEGFA MKNK1 2345/4885NOTUM 810/4885RECQL 258/4885

“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.