SCHEMBL289594

SCHEMBL289594

CNc1sc(-c2cncc(F)c2)nc1C#N

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 3/20 0.46
CYP11B1 P15538 4/20 0.40
CYP11B2 P19099 4/20 0.40
APP P05067 4/20 0.34
PIK3CG P48736 1/20 0.34
DYRK1A Q13627 2/20 0.33
ADORA2B P29275 1/20 0.32
ADORA1 P30542 1/20 0.32
TBK1 Q9UHD2 1/20 0.32
TLR7 Q9NYK1 2/20 0.32
PIM1 P11309 1/20 0.31
CYP1A2 P05177 1/20 0.31
CYP3A4 P08684 1/20 0.31
CYP2C19 P33261 1/20 0.31

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
SCHEMBL290713 0.81 APP (0.38) CYP11B1CYP11B2APPPIK3CGDYRK1A
Hydrochloric Acid SCHEMBL17629274 0.80 APP (0.37) CYP11B1CYP11B2APPPIK3CGDYRK1A
SCHEMBL18569239 0.79 APP (0.36) CYP11B1CYP11B2APPPIK3CGDYRK1A
SCHEMBL13048833 0.78 PIK3CG (0.38) CYP11B1CYP11B2PIK3CGDYRK1ATBK1
SCHEMBL18569065 0.78 CYP11B1 (0.40) CYP11B1CYP11B2APPPIK3CGDYRK1A
SCHEMBL13048814 0.77 TBK1 (0.39) CYP11B1CYP11B2PIK3CGDYRK1ATBK1
SCHEMBL15109438 0.75 TBK1 (0.38) CYP11B1CYP11B2PIK3CGDYRK1ATBK1
SCHEMBL16652406 0.71 PIK3CG (0.33) CYP11B1CYP11B2APPPIK3CGDYRK1A
SCHEMBL17641052 0.71 PIM1 (0.38) CYP11B1CYP11B2APPPIK3CGDYRK1A
SCHEMBL25405384 0.70 PIK3CG (0.44) PIK3CGDYRK1APIM1CYP1A2CYP3A4

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 20 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-9357780-B2 Pesticidal compositions DOW AGROSCIENCES LLC (US) 2016-06-07 US disclosed
EP-2614825-B1 Process for the preparation of thiazole derivatives DOW AGROSCIENCES LLC (US) 2016-03-16 EP disclosed
EP-2427191-B1 PESTICIDAL COMPOSITIONS DOW AGROSCIENCES LLC (US) 2016-03-16 EP disclosed
EP-2604267-B1 Process for the preparation of thiazole derivatives DOW AGROSCIENCES LLC (US) 2016-02-03 EP disclosed
EP-2604268-B1 Process for the preparation of thiazole derivatives DOW AGROSCIENCES LLC (US) 2015-09-16 EP 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-20140348947-A1 PESTICIDAL COMPOSITIONS DOW AGROSCIENCES LLC (US) 2014-11-27 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
EP-2614826-A1 Process for preparation of thiazole derivatives Dow AgroSciences LLC (US) 2013-07-17 EP disclosed
EP-2604268-A1 Process for the preparation of thiazole derivatives Dow AgroSciences LLC (US) 2013-06-19 EP disclosed
EP-2604267-A1 Process for the preparation of thiazole derivatives Dow AgroSciences LLC (US) 2013-06-19 EP 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-8350044-B2 Pesticidal compositions DOW AGROSCIENCES, LLC. (US) 2013-01-08 US disclosed
EP-2427191-A1 PESTICIDAL COMPOSITIONS Dow AgroSciences LLC (US) 2012-03-14 EP disclosed
US-20100292253-A1 PESTICIDAL COMPOSITIONS DOW AGROSCIENCES LLC (US) 2010-11-18 US disclosed
WO-2010129497-A1 PESTICIDAL COMPOSITIONS DOW AGROSCIENCES LLC (US) 2010-11-11 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 (5 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 ALOX15 1834/4885CYP11B1 821/4885CYP11B2 699/4885
US-20130089622-A1 PESTICIDAL COMPOSITIONS ACHE, DDT, PRDX6 ALOX15 1834/4885CYP11B1 821/4885CYP11B2 699/4885
US-20140348947-A1 PESTICIDAL COMPOSITIONS ACHE, DDT, PRDX6 ALOX15 1834/4885CYP11B1 821/4885CYP11B2 699/4885
US-20150045218-A1 PESTICIDAL COMPOSITIONS ACHE, DDT, PRDX6 ALOX15 1834/4885CYP11B1 821/4885CYP11B2 699/4885
US-20130072382-A1 PESTICIDAL COMPOSITIONS ACHE, DDT, PRDX6 ALOX15 1834/4885CYP11B1 821/4885CYP11B2 699/4885

“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.