SCHEMBL12239302

SCHEMBL12239302

Cc1cc(C)c(C2C(=O)CC(CC3CCN(S(=O)(=O)c4ccc(Cl)cc4)CC3)C2=O)c(C)c1

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.46
ALDH1A1 P00352 3/20 0.41
PKM P14618 1/20 0.41
EPHX2 P34913 2/20 0.41
HTT P42858 2/20 0.40
POLB P06746 2/20 0.40
GAA P10253 1/20 0.40
KMT2A Q03164 2/20 0.40
ATM Q13315 1/20 0.40
PTGDR2 Q9Y5Y4 2/20 0.40
TP53 P04637 1/20 0.39
MAPT P10636 2/20 0.39
MEN1 O00255 1/20 0.38
MAPK1 P28482 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
SCHEMBL12239316 0.93 ALDH1A1 (0.43) LMNAALDH1A1PKMHTTPOLB
SCHEMBL12239296 0.90 ALDH1A1 (0.42) LMNAALDH1A1PKMEPHX2HTT
SCHEMBL12239318 0.88 ALDH1A1 (0.45) ALDH1A1HTTPOLBPTGDR2MAPT
SCHEMBL12239264 0.85 ACHE (0.38) LMNAALDH1A1POLBKMT2AMAPT
SCHEMBL12239303 0.84 EBP (0.35) ALDH1A1EPHX2POLBKMT2AMEN1
SCHEMBL12239298 0.84 POLB (0.37) ALDH1A1EPHX2POLBKMT2AMEN1
SCHEMBL12239297 0.81 FAAH (0.35) EPHX2POLB
SCHEMBL12239286 0.81 MGLL (0.46) LMNAALDH1A1POLBKMT2AMAPT
SCHEMBL12239321 0.81 EPHX2 (0.33) LMNAEPHX2POLB
SCHEMBL12239244 0.80 EBP (0.34) EPHX2POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2313370-B1 5-HETEROCYCLYLALKYL-3-HYDROXY-2-PHENYLCYCLOPENT-2-ENONES AS HERBICIDES SYNGENTA LTD (GB) 2015-08-19 EP disclosed
US-9096560-B2 5-heterocyclylalkyl-3-hydroxy-2-phenylcyclopent-2-enones as herbicides SYNGENTA LIMITED (GB) 2015-08-04 US disclosed
US-9096560-B2 5-heterocyclylalkyl-3-hydroxy-2-phenylcyclopent-2-enones as herbicides SYNGENTA LIMITED (GB) 2015-08-04 US disclosed
US-20130053385-A1 METHOD OF COMBATING AND CONTROLLING PESTS SYNGENTA LIMITED (GB) 2013-02-28 US disclosed
US-20130053385-A1 METHOD OF COMBATING AND CONTROLLING PESTS SYNGENTA LIMITED (GB) 2013-02-28 US disclosed
US-20110263428-A1 5-HETEROCYCLYLALKYL-3-HYDROXY-2-PHENYLCYCLOPENT-2-ENONES AS HERBICIDES SYNGENTA CROP PROTECTION, INC. (US) 2011-10-27 US disclosed
US-20110263428-A1 5-HETEROCYCLYLALKYL-3-HYDROXY-2-PHENYLCYCLOPENT-2-ENONES AS HERBICIDES SYNGENTA CROP PROTECTION, INC. (US) 2011-10-27 US disclosed
WO-2011073060-A2 METHOD OF COMBATING AND CONTROLLING PESTS SYNGENTA PARTICIPATIONS AG (CH) 2011-06-23 WO disclosed
WO-2010000773-A1 5-HETEROCYCLYLALKYL-3-HYDROXY-2-PHENYLCYCLOPENT-2-ENONES AS HERBICIDES SYNGENTA LIMITED (GB) 2010-01-07 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-20110263428-A1 5-HETEROCYCLYLALKYL-3-HYDROXY-2-PHENYLCYCLOPENT-2-ENONES AS HERBICIDES DDT, CYP1B1, AHR LMNA 3252/4885ALDH1A1 50/4885PKM 1184/4885
US-20130053385-A1 METHOD OF COMBATING AND CONTROLLING PESTS ACHE, ALG1, KEAP1 LMNA 1745/4885ALDH1A1 386/4885PKM 2085/4885

“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.