SCHEMBL2053284

SCHEMBL2053284

Cc1csc(-c2ccn(C(C)C)n2)c1

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
DYRK1A Q13627 1/20 0.40
MET P08581 3/20 0.39
TDP2 O95551 2/20 0.35
HPGDS O60760 2/20 0.33
KDM5B Q9UGL1 1/20 0.33
IRAK4 Q9NWZ3 1/20 0.32
GRIN2B Q13224 2/20 0.30
GABRA1 P14867 1/20 0.30
GABRG2 P18507 1/20 0.30
GABRB3 P28472 1/20 0.30
GABRA5 P31644 1/20 0.30
GABRA3 P34903 1/20 0.30
GABRA2 P47869 1/20 0.30
GRIN1 Q05586 1/20 0.30
BACE1 P56817 1/20 0.30

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
SCHEMBL2051571 0.85 MET (0.39) METTDP2HPGDSKDM5BGRIN2B
SCHEMBL2051388 0.84 DYRK1A (0.40) DYRK1ATDP2BACE1
SCHEMBL14335673 0.74 DYRK1A (0.40) DYRK1A
SCHEMBL27015063 0.72 DYRK1A (0.48) DYRK1AKDM5B
SCHEMBL2050809 0.72 MET (0.40) METTDP2GRIN2BGRIN1BACE1
SCHEMBL27015076 0.71 PDE10A (0.45) DYRK1AIRAK4GABRA1GABRG2GABRB3
SCHEMBL2609419 0.70 DYRK1A (0.45) DYRK1A
SCHEMBL2050710 0.70 DYRK1A (0.39) DYRK1A
SCHEMBL14335979 0.70 DYRK1A (0.39) DYRK1AGRIN2B
SCHEMBL2054185 0.70 TDP2 (0.37) TDP2KDM5BGRIN2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2516423-A1 THIENYLPYRI (MI) DINYLAZOLE AND THEIR USE FOR CONTROLLING PHYTOPATHOGENIC FUNGI Bayer CropScience AG (DE) 2012-10-31 EP disclosed
CN-102762551-A Thienylpyri (mi) dinylpyrazoles and their use for controlling phytopathogenic fungi BAYER CROPSCIENCE AG 2012-10-31 CN disclosed
US-20110237588-A1 Thienylpyri(mi)dinylazole BAYER CROPSCIENCE AG (DE) 2011-09-29 US disclosed
WO-2011076725-A1 THIENYLPYRI (MI) DINYLAZOLE AND THEIR USE FOR CONTROLLING PHYTOPATHOGENIC FUNGI BAYER CROPSCIENCE AG (DE) 2011-06-30 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-20110237588-A1 Thienylpyri(mi)dinylazole PADI1, TH, H1-3 DYRK1A 1013/4885MET 3340/4885TDP2 2004/4885

“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.