SCHEMBL13434847

SCHEMBL13434847

Fc1ccc(Nc2ncnc3ccsc23)c(OCCC(F)(F)F)c1

nearest known ligand 0.54

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MKNK2 Q9HBH9 12/20 0.54
MKNK1 Q9BUB5 2/20 0.54
AURKA O14965 1/20 0.43
TEK Q02763 1/20 0.43
AURKB Q96GD4 1/20 0.43
EGFR P00533 2/20 0.41
FADS1 O60427 1/20 0.41
BRAF P15056 1/20 0.40
TNNI3K Q59H18 1/20 0.40
EIF4E P06730 1/20 0.40
DYRK1A Q13627 1/20 0.39
DYRK1B Q9Y463 1/20 0.39
FLT1 P17948 2/20 0.39
FGFR1 P11362 1/20 0.39
KDR P35968 1/20 0.39
NTRK1 P04629 1/20 0.38

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
SCHEMBL15428429 0.92 MKNK2 (0.49) MKNK2MKNK1AURKATEKAURKB
SCHEMBL13434854 0.84 EGFR (0.47) MKNK2MKNK1AURKATEKAURKB
SCHEMBL13434840 0.84 MKNK2 (0.45) MKNK2MKNK1AURKATEKAURKB
SCHEMBL13434882 0.83 MKNK2 (0.59) MKNK2MKNK1EIF4EDYRK1ADYRK1B
SCHEMBL3798130 0.83 MKNK2 (0.58) MKNK2MKNK1EGFR
SCHEMBL13434851 0.82 DYRK1A (0.55) MKNK2MKNK1AURKATEKAURKB
SCHEMBL13434858 0.81 MKNK2 (0.56) MKNK2MKNK1
SCHEMBL13434849 0.79 MKNK2 (0.53) MKNK2MKNK1AURKATEKAURKB
SCHEMBL15428425 0.77 MKNK2 (0.45) MKNK2MKNK1AURKATEKAURKB
SCHEMBL15428428 0.77 MKNK2 (0.63) MKNK2MKNK1AURKATEKAURKB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8633201-B2 Thienopyrimidines having Mnk1/Mnk2 inhibiting activity for pharmaceutical compositions BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2014-01-21 US disclosed
US-8633201-B2 Thienopyrimidines having Mnk1/Mnk2 inhibiting activity for pharmaceutical compositions BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2014-01-21 US disclosed
EP-2004656-B1 THIENOPYRIMIDINES HAVING MNK1 /MNK2 INHIBITING ACTIVITY FOR PHARMACEUTICAL COMPOSITIONS BOEHRINGER INGELHEIM INT (DE) 2013-07-10 EP disclosed
US-20100056548-A1 THIENOPYRIMIDINES HAVING MNK1/MNK2 INHIBITING ACTIVITY FOR PHARMACEUTICAL COMPOSITIONS DEVELOGEN AKTIENGESELLSCHAFT (DE) 2010-03-04 US disclosed
US-20100056548-A1 THIENOPYRIMIDINES HAVING MNK1/MNK2 INHIBITING ACTIVITY FOR PHARMACEUTICAL COMPOSITIONS DEVELOGEN AKTIENGESELLSCHAFT (DE) 2010-03-04 US disclosed
WO-2007115822-A1 THIENOPYRIMIDINES HAVING MNKL /MNK2 INHIBITING ACTIVITY FOR PHARMACEUTICAL COMPOSITIONS DEVELOGEN AKTIENGESELLSCHAFT (DE) 2007-10-18 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-20100056548-A1 THIENOPYRIMIDINES HAVING MNK1/MNK2 INHIBITING ACTIVITY FOR PHARMACEUTICAL COMPOSITIONS CMPK1, DTYMK, NEK9 MKNK2 8/4885MKNK1 29/4885AURKA 341/4885

“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.