SCHEMBL12239294

SCHEMBL12239294

Cc1cc(C)c(C2C(=O)CC(CC3CCN(C(=O)OCC(Cl)(Cl)Cl)CC3)C2=O)c(C)c1

nearest known ligand 0.38

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
MAPK1 P28482 1/20 0.38
EPHX2 P34913 2/20 0.35
GAA P10253 2/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
ALOX12 P18054 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.33
ENPP2 Q13822 3/20 0.32
TSHR P16473 2/20 0.32
HTT P42858 2/20 0.32
NPSR1 Q6W5P4 1/20 0.32
HSD17B10 Q99714 1/20 0.32
GRIN2B Q13224 1/20 0.32
FAAH O00519 1/20 0.32
TP53 P04637 1/20 0.31
USP2 O75604 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
SCHEMBL12239315 0.90 MEN1 (0.45) MEN1KMT2AMAPK1GAASMN1; SMN2
SCHEMBL12239310 0.87 MEN1 (0.36) MEN1KMT2AMAPK1EPHX2GAA
SCHEMBL12239266 0.86 EPHX2 (0.45) MEN1KMT2AEPHX2FAAHTP53
SCHEMBL12239305 0.86 BRD4 (0.37) MEN1KMT2AMAPK1EPHX2GAA
SCHEMBL12239330 0.85 MEN1 (0.36) MEN1KMT2AMAPK1GAASMN1; SMN2
SCHEMBL12239312 0.85 MAPT (0.32) MEN1KMT2AMAPK1EPHX2
SCHEMBL12239308 0.85 MAPK1 (0.36) MEN1KMT2AMAPK1GAASMN1; SMN2
SCHEMBL12239277 0.85 MEN1 (0.38) MEN1KMT2AMAPK1GAASMN1; SMN2
SCHEMBL12239314 0.83 FAAH (0.39) MEN1KMT2AMAPK1EPHX2FAAH
SCHEMBL12239232 0.82 MAPT (0.36) MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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-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 MEN1 3917/4885KMT2A 745/4885MAPK1 2011/4885
US-20130053385-A1 METHOD OF COMBATING AND CONTROLLING PESTS ACHE, ALG1, KEAP1 MEN1 2172/4885KMT2A 2336/4885MAPK1 3362/4885

“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.