SCHEMBL2500399

SCHEMBL2500399

COC(=O)c1sc(-c2cnc3ccc(OCCO[Si](C)(C)C(C)(C)C)cn23)cc1O

nearest known ligand 0.34

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PLK1 P53350 11/20 0.34
MAPT P10636 2/20 0.33
PLK3 Q9H4B4 1/20 0.33
PLK2 Q9NYY3 1/20 0.33
PRMT5 O14744 1/20 0.32
WDR77 Q9BQA1 1/20 0.32
RIPK2 O43353 2/20 0.32
CLK1 P49759 1/20 0.32
DYRK1A Q13627 1/20 0.32
RAB9A P51151 1/20 0.31
MKNK1 Q9BUB5 2/20 0.30
MKNK2 Q9HBH9 2/20 0.30
FYN P06241 1/20 0.30
EIF4E P06730 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
SCHEMBL2499008 0.86 PLK1 (0.40) PLK1PLK3PLK2RIPK2
SCHEMBL2495147 0.84 IRAK4 (0.40) PLK1PRMT5WDR77RIPK2CLK1
SCHEMBL2504630 0.83 DGAT1 (0.33) PLK1PLK3PLK2
SCHEMBL2496368 0.82 PLK1 (0.32) PLK1PLK3PLK2RIPK2MKNK1
SCHEMBL2502787 0.77 PIK3CA (0.46) PLK1RIPK2MKNK1MKNK2FYN
SCHEMBL2500397 0.77 TBXAS1 (0.30)
SCHEMBL2495476 0.73 PLK1 (0.51) PLK1PLK3PLK2
SCHEMBL2504943 0.70 DUT (0.34)
SCHEMBL19717306 0.69 MAPT (0.69) MAPTRAB9A
SCHEMBL2503594 0.69 KDR (0.36) PLK1PLK3PLK2RIPK2

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-1813613-B1 NOVEL FUSED IMIDAZOLE DERIVATIVE MSD KK (JP) 2012-12-19 EP disclosed
US-8030327-B2 3-[1-(2-chlorophenyl)ethoxy]-5-imidazo[1,2-a]pyridin-3-ylthiophene-2-carboxyamide; polo like kinase inhibitor; antitumor and anticarcinogenic agent; mitotic phase (M phase) of the cell cycle MDS K.K. (JP) 2011-10-04 US disclosed
US-20080103136-A1 Novel Fused Imidazole Derivative MSD K.K. (JP) 2008-05-01 US disclosed
EP-1813613-A1 NOVEL FUSED IMIDAZOLE DERIVATIVE BANYU PHARMACEUTICAL CO., LTD. (JP) 2007-08-01 EP 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-20080103136-A1 Novel Fused Imidazole Derivative HRH4, H1-4, H1-3 PLK1 4301/4885MAPT 4346/4885PLK3 3835/4885

“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.