SCHEMBL5334636

SCHEMBL5334636

O=C(O)c1cc(Nc2ncnc3ccsc23)cc(C(=O)O)c1

nearest known ligand 0.55

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
EGFR P00533 2/20 0.55
FADS1 O60427 1/20 0.55
PIP4K2C Q8TBX8 1/20 0.54
ALDH1A1 P00352 1/20 0.51
GAA P10253 1/20 0.51
FLT1 P17948 1/20 0.51
CSNK2A1 P68400 4/20 0.49
AURKA O14965 1/20 0.48
AURKB Q96GD4 1/20 0.48
NTRK1 P04629 6/20 0.47
PDE4A P27815 1/20 0.46
PDE4B Q07343 1/20 0.46
PDE4C Q08493 1/20 0.46
PDE4D Q08499 1/20 0.46
PDE3B Q13370 1/20 0.46
PDE3A Q14432 1/20 0.46
TEK Q02763 1/20 0.46
KDM4E B2RXH2 1/20 0.45
SYK P43405 1/20 0.45

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
SCHEMBL5369046 0.80 EGFR (0.60) EGFRFADS1PIP4K2CFLT1AURKA
SCHEMBL24466918 0.80 EGFR (0.64) EGFRFADS1PIP4K2CALDH1A1GAA
SCHEMBL29808690 0.80 EGFR (0.64) EGFRFADS1PIP4K2CALDH1A1GAA
SCHEMBL13434856 0.79 FADS1 (0.59) EGFRFADS1PIP4K2CFLT1CSNK2A1
SCHEMBL5455935 0.79 EGFR (0.62) EGFRFADS1PIP4K2CFLT1AURKA
SCHEMBL29808582 0.78 PIP4K2C (0.61) EGFRFADS1PIP4K2CFLT1CSNK2A1
SCHEMBL13434848 0.78 PIP4K2C (0.61) EGFRFADS1PIP4K2CFLT1CSNK2A1
SCHEMBL30715841 0.78 EGFR (0.69) EGFRFADS1PIP4K2CFLT1CSNK2A1
SCHEMBL5331005 0.77 CSNK2A1 (0.58) EGFRFADS1PIP4K2CCSNK2A1
SCHEMBL13434857 0.75 PIP4K2C (0.54) EGFRFADS1PIP4K2CFLT1AURKA

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
WO-2007056215-A9 N-ARYL-THIENOPYRIMIDIN-4-AMINES AND THE USE THEREOF CYTOVIA INC (US) 2007-09-13 WO claimed
US-20070099877-A1 N-aryl-thienopyrimidin-4-amines and analogs as activators of caspases and inducers of apoptosis and the use thereof CYTOVIA, INC. (US) 2007-05-03 US claimed
US-20070099877-A1 N-aryl-thienopyrimidin-4-amines and analogs as activators of caspases and inducers of apoptosis and the use thereof CYTOVIA, INC. (US) 2007-05-03 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 (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-20070099877-A1 N-aryl-thienopyrimidin-4-amines and analogs as activators of caspases and inducers of apoptosis and the use thereof CASP4, CASP3, API5 EGFR 1226/4885FADS1 1782/4885PIP4K2C 2195/4885

“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.