SCHEMBL2051571

SCHEMBL2051571

CCC(C)n1ccc(-c2cc(C)cs2)n1

nearest known ligand 0.39

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MET P08581 3/20 0.39
TDP2 O95551 2/20 0.34
AR P10275 1/20 0.32
HPGDS O60760 2/20 0.31
GRIN2B Q13224 2/20 0.31
GRIN1 Q05586 1/20 0.31
KDM5B Q9UGL1 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
SCHEMBL2053284 0.85 DYRK1A (0.40) METTDP2HPGDSGRIN2BGRIN1
SCHEMBL2051546 0.77 KDM4E (0.43)
SCHEMBL2050605 0.76 MET (0.41) METTDP2GRIN2BGRIN1
SCHEMBL2053087 0.75 MET (0.42) METTDP2GRIN2BGRIN1
SCHEMBL2050809 0.74 MET (0.40) METTDP2GRIN2BGRIN1
SCHEMBL2053942 0.73 TDP2 (0.36) TDP2GRIN2BKDM5B
SCHEMBL2051388 0.70 DYRK1A (0.40) TDP2
SCHEMBL2053415 0.69 L3MBTL1 (0.41) GRIN2BGRIN1KDM5B
SCHEMBL19608586 0.68 DYRK1A (0.38)
SCHEMBL22867118 0.68 ACHE (0.36)

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 MET 3340/4885TDP2 2004/4885AR 3181/4885

“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.