SCHEMBL2834484

SCHEMBL2834484

O=C1NC(=O)C(c2c(Cl)cccc2Cl)=C1O

nearest known ligand 0.47

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CES1 P23141 2/20 0.47
GSK3B P49841 9/20 0.46
STK10 O94804 7/20 0.46
SLK Q9H2G2 7/20 0.46
GSK3A P49840 3/20 0.44
TGM2 P21980 3/20 0.41
RET P07949 1/20 0.41
GRK5 P34947 1/20 0.41
TYRO3 Q06418 1/20 0.41
DYRK1B Q9Y463 1/20 0.41
CHEK1 O14757 1/20 0.40
WEE1 P30291 1/20 0.40
PBRM1 Q86U86 1/20 0.39
NSD2 O96028 1/20 0.39
BCHE P06276 1/20 0.39
DAO P14920 1/20 0.39
ADORA2A P29274 1/20 0.38
ADORA1 P30542 1/20 0.38
BRDT Q58F21 1/20 0.38

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
SCHEMBL30445783 0.86 CES1 (0.55) CES1GSK3BSTK10SLKGSK3A
SCHEMBL2834495 0.80 CES1 (0.50) CES1GSK3BSTK10SLKGSK3A
SCHEMBL12424909 0.74 CES1 (0.52) CES1GSK3BSTK10SLKGSK3A
SCHEMBL30999976 0.73 GSK3B (0.59) GSK3BSTK10SLKGSK3ACHEK1
Zinc Ion SCHEMBL29019629 0.72 CES1 (0.39) CES1GSK3BSTK10SLKGSK3A
SCHEMBL2834835 0.70 PRKCB (0.74) GSK3B
SCHEMBL187764 0.69 PTGS2 (0.61) GSK3B
SCHEMBL261439 0.69 GSK3B (0.52) CES1GSK3BSTK10SLKTGM2
SCHEMBL2838987 0.69 PPOX (0.52) CES1GSK3BSTK10SLKGSK3A
SCHEMBL12425026 0.67 PBRM1 (0.45) CES1GSK3BSTK10SLKTGM2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100152044-A1 Plant growth regulation BAYER CROPSCIENCE GMBH (DE) 2010-06-17 US disclosed
EP-1746886-A1 PLANT GROWTH REGULATION Bayer CropScience GmbH (DE) 2007-01-31 EP disclosed
WO-2005107465-A1 PLANT GROWTH REGULATION BAYER CROPSCIENCE GMBH (DE) 2005-11-17 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-20100152044-A1 Plant growth regulation ING2, GHITM, MYB CES1 3454/4885GSK3B 522/4885STK10 887/4885

“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.