SCHEMBL13048201

SCHEMBL13048201

CC(C)(C)OC(=O)Nc1sc(-c2cncc(F)c2)nc1Br

nearest known ligand 0.40

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
DYRK1A Q13627 4/20 0.40
LCK P06239 5/20 0.39
PIK3CG P48736 1/20 0.38
ABL1 P00519 1/20 0.34
CYP17A1 P05093 1/20 0.34
POLQ O75417 1/20 0.34
SYK P43405 1/20 0.34
ADORA2B P29275 1/20 0.33
ADORA3 P0DMS8 1/20 0.33
ADORA2A P29274 1/20 0.33
ADORA1 P30542 1/20 0.33
PIM1 P11309 1/20 0.33
CTPS1 P17812 1/20 0.33
CLK1 P49759 1/20 0.32
CLK2 P49760 1/20 0.32
DYRK2 Q92630 1/20 0.32
CLK4 Q9HAZ1 1/20 0.32
DYRK1B Q9Y463 1/20 0.32

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
SCHEMBL3744202 0.89 DYRK1A (0.43) DYRK1ALCKPIK3CGABL1CYP17A1
SCHEMBL30617081 0.88 DYRK1A (0.41) DYRK1ALCKPIK3CGABL1CYP17A1
SCHEMBL13074537 0.88 DYRK1A (0.41) DYRK1ALCKPIK3CGABL1CYP17A1
SCHEMBL13048243 0.88 DYRK1A (0.41) DYRK1ALCKPIK3CGABL1CYP17A1
SCHEMBL289332 0.87 DYRK1A (0.42) DYRK1ALCKPIK3CGABL1CYP17A1
SCHEMBL290706 0.78 SYK (0.39) DYRK1ALCKPIK3CGABL1CYP17A1
SCHEMBL13048296 0.78 DYRK1A (0.34) DYRK1APIK3CGPOLQADORA2BADORA2A
SCHEMBL3752096 0.77 PAX8 (0.40) DYRK1APIK3CGABL1ADORA2BADORA2A
SCHEMBL18569239 0.77 APP (0.36) DYRK1APIK3CGCYP17A1PIM1
SCHEMBL13048209 0.76 PIK3CG (0.37) DYRK1APIK3CGABL1POLQPIM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2614826-B1 Process for preparation of thiazole derivatives DOW AGROSCIENCES LLC (US) 2017-03-01 EP disclosed
US-9006446-B2 Pesticidal compositions DOW AGROSCIENCES LLC (US) 2015-04-14 US disclosed
US-9006446-B2 Pesticidal compositions DOW AGROSCIENCES LLC (US) 2015-04-14 US disclosed
US-20150045218-A1 PESTICIDAL COMPOSITIONS DOW AGROSCIENCES LLC (US) 2015-02-12 US disclosed
US-20150045218-A1 PESTICIDAL COMPOSITIONS DOW AGROSCIENCES LLC (US) 2015-02-12 US disclosed
US-8853246-B2 Pesticidal compositions DOW AGROSCIENCES, LLC. (US) 2014-10-07 US disclosed
US-8853246-B2 Pesticidal compositions DOW AGROSCIENCES, LLC. (US) 2014-10-07 US disclosed
EP-2614825-A1 Process for the preparation of thiazole derivatives Dow AgroSciences LLC (US) 2013-07-17 EP disclosed
US-20130089622-A1 PESTICIDAL COMPOSITIONS DOW AGROSCIENCES LLC (US) 2013-04-11 US disclosed
US-20130089622-A1 PESTICIDAL COMPOSITIONS DOW AGROSCIENCES LLC (US) 2013-04-11 US disclosed
US-20130072382-A1 PESTICIDAL COMPOSITIONS DOW AGROSCIENCES LLC (US) 2013-03-21 US disclosed
US-20130072382-A1 PESTICIDAL COMPOSITIONS DOW AGROSCIENCES LLC (US) 2013-03-21 US disclosed
US-8350044-B2 Pesticidal compositions DOW AGROSCIENCES, LLC. (US) 2013-01-08 US disclosed
US-8350044-B2 Pesticidal compositions DOW AGROSCIENCES, LLC. (US) 2013-01-08 US disclosed
US-20100292253-A1 PESTICIDAL COMPOSITIONS DOW AGROSCIENCES LLC (US) 2010-11-18 US disclosed
US-20100292253-A1 PESTICIDAL COMPOSITIONS DOW AGROSCIENCES LLC (US) 2010-11-18 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 (4 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-20100292253-A1 PESTICIDAL COMPOSITIONS ACHE, DDT, PRDX6 DYRK1A 3841/4885LCK 3070/4885PIK3CG 795/4885
US-20130089622-A1 PESTICIDAL COMPOSITIONS ACHE, DDT, PRDX6 DYRK1A 3841/4885LCK 3070/4885PIK3CG 795/4885
US-20150045218-A1 PESTICIDAL COMPOSITIONS ACHE, DDT, PRDX6 DYRK1A 3841/4885LCK 3070/4885PIK3CG 795/4885
US-20130072382-A1 PESTICIDAL COMPOSITIONS ACHE, DDT, PRDX6 DYRK1A 3841/4885LCK 3070/4885PIK3CG 795/4885

“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.