SCHEMBL14234366

SCHEMBL14234366

Cc1cc(C)c(C2=C(O)CC(C(C)CS(=O)(=O)c3ccc(C(F)(F)F)cc3)CC2=O)c(C)c1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 2/20 0.35
CHEK1 O14757 1/20 0.34
AURKA O14965 1/20 0.34
NTRK1 P04629 1/20 0.34
MET P08581 1/20 0.34
PIM1 P11309 1/20 0.34
FGFR1 P11362 1/20 0.34
PRKACA P17612 1/20 0.34
GRK5 P34947 1/20 0.34
MAP2K2 P36507 1/20 0.34
FLT3 P36888 1/20 0.34
MAPK8 P45983 1/20 0.34
MAPK9 P45984 1/20 0.34
CDK8 P49336 1/20 0.34
GSK3B P49841 1/20 0.34
CDK7 P50613 1/20 0.34
CDK9 P50750 1/20 0.34
RPS6KA3 P51812 1/20 0.34
LIMK1 P53667 1/20 0.34
CDK5 Q00535 1/20 0.34

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
SCHEMBL15944321 0.91 ALDH1A1 (0.39) HSD11B1ALDH1A1MAPT
SCHEMBL14234206 0.90 HSD11B1 (0.34) HSD11B1CHEK1AURKANTRK1MET
SCHEMBL14234990 0.86 POLB (0.40) ALDH1A1PKM
SCHEMBL19335607 0.84 MAOA (0.36) HSD11B1CHEK1AURKANTRK1MET
SCHEMBL14234799 0.83 HCRTR2 (0.32)
SCHEMBL14235149 0.82 APOB (0.34) APOBMTTPMAOAMAOB
SCHEMBL14234219 0.81 PPARD (0.36) APOBMTTPMAOAMAOB
SCHEMBL15944305 0.81 ALDH1A1 (0.36) ALDH1A1MAPT
SCHEMBL15944324 0.78 GRIA2 (0.31)
SCHEMBL14234201 0.77 POLB (0.41) ALDH1A1PKM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9414588-B2 Herbicide composition SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2016-08-16 US disclosed
US-20150289505-A1 HERBICIDE COMPOSITION SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2015-10-15 US disclosed
US-9101140-B2 Cyclohexanone compounds and herbicides comprising the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2015-08-11 US disclosed
US-20140228219-A1 CYCLOHEXANONE COMPOUNDS AND HERBICIDES COMPRISING THE SAME SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2014-08-14 US disclosed
WO-2012165648-A1 CYCLOHEXANONE COMPOUNDS AND HERBICIDES COMPRISING THE SAME SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-12-06 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 (2 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-20140228219-A1 CYCLOHEXANONE COMPOUNDS AND HERBICIDES COMPRISING THE SAME CBR3, CBR1, CYP2S1 HSD11B1 521/4885CHEK1 930/4885AURKA 1947/4885
US-20150289505-A1 HERBICIDE COMPOSITION DDT, DHFR, DERL1 HSD11B1 626/4885CHEK1 3873/4885AURKA 1609/4885

“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.