SCHEMBL13047740

SCHEMBL13047740

Cc1nc(-c2cncc(F)c2)sc1NC(=O)CC[S+](C)[O-]

nearest known ligand 0.36

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PIK3CG P48736 1/20 0.36
DYRK1A Q13627 7/20 0.36
CYP1A2 P05177 2/20 0.35
CYP3A4 P08684 2/20 0.35
CYP2C19 P33261 1/20 0.35
GSK3B P49841 3/20 0.34
PIM1 P11309 1/20 0.33
LMNA P02545 1/20 0.33
MAPK13 O15264 1/20 0.33
MAPK12 P53778 1/20 0.33
MAPK11 Q15759 1/20 0.33
MAPK14 Q16539 1/20 0.33
POLQ O75417 1/20 0.32
CHRNA7 P36544 1/20 0.32
KCNH2 Q12809 1/20 0.32
ABL1 P00519 1/20 0.32
TP53 P04637 1/20 0.32
CHRM4 P08173 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
SCHEMBL13075080 0.91 PIK3CG (0.37) PIK3CGDYRK1ACYP1A2CYP3A4CYP2C19
SCHEMBL13048691 0.89 PIK3CG (0.36) PIK3CGDYRK1AGSK3BPIM1CHRNA7
SCHEMBL13047722 0.83 LMNA (0.39) PIK3CGDYRK1ACYP1A2CYP3A4CYP2C19
SCHEMBL13047681 0.82 CYP1A2 (0.51) CYP1A2CYP3A4CYP2C19LMNA
SCHEMBL13047742 0.82 PIK3CG (0.37) PIK3CGDYRK1ACYP1A2CYP3A4CYP2C19
SCHEMBL13047723 0.82 PIK3CG (0.35) PIK3CGDYRK1ACYP1A2CYP3A4CYP2C19
SCHEMBL13047732 0.82 PIK3CG (0.35) PIK3CGDYRK1ACYP1A2CYP3A4CYP2C19
SCHEMBL25405384 0.81 PIK3CG (0.44) PIK3CGDYRK1ACYP1A2CYP3A4CYP2C19
SCHEMBL13047674 0.79 PIK3CG (0.32) PIK3CGDYRK1ACYP1A2CYP3A4CYP2C19
SCHEMBL18569322 0.79 CYP1A2 (0.38) PIK3CGDYRK1ACYP1A2CYP3A4CYP2C19

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 17 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
EP-2427191-B1 PESTICIDAL COMPOSITIONS DOW AGROSCIENCES LLC (US) 2016-03-16 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
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
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 (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 PIK3CG 795/4885DYRK1A 3841/4885CYP1A2 327/4885
US-20130089622-A1 PESTICIDAL COMPOSITIONS ACHE, DDT, PRDX6 PIK3CG 795/4885DYRK1A 3841/4885CYP1A2 327/4885
US-20150045218-A1 PESTICIDAL COMPOSITIONS ACHE, DDT, PRDX6 PIK3CG 795/4885DYRK1A 3841/4885CYP1A2 327/4885
US-20130072382-A1 PESTICIDAL COMPOSITIONS ACHE, DDT, PRDX6 PIK3CG 795/4885DYRK1A 3841/4885CYP1A2 327/4885

“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.