SCHEMBL4614812

SCHEMBL4614812

COCC(Oc1cc(Cl)cc(Cl)c1)C(=O)OC

nearest known ligand 0.39

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HPGD P15428 3/20 0.38
L3MBTL1 Q9Y468 2/20 0.36
ALDH1A1 P00352 2/20 0.36
CARM1 Q86X55 1/20 0.35
PRMT6 Q96LA8 1/20 0.35
LMNA P02545 1/20 0.35
KDM4E B2RXH2 1/20 0.34
MAPK1 P28482 1/20 0.34
HTT P42858 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
HSD17B10 Q99714 1/20 0.34
MAPT P10636 1/20 0.34
PPARG P37231 2/20 0.34
PPARA Q07869 2/20 0.34
OGG1 O15527 1/20 0.34
GRN P28799 1/20 0.34
SORT1 Q99523 1/20 0.34
GCK P35557 2/20 0.33

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
SCHEMBL4613034 0.85 PPARG (0.48) PPARGPPARA
SCHEMBL19912667 0.78 PPARA (0.56) PPARGPPARA
SCHEMBL19555445 0.78 PPARG (0.53) L3MBTL1LMNAHTTMAPTPPARG
SCHEMBL19803711 0.78 PPARA (0.56) PPARGPPARA
SCHEMBL17724580 0.77 TSHR (0.47) HPGDL3MBTL1ALDH1A1LMNAMAPT
SCHEMBL23809782 0.76 HTRA1 (0.47) ALDH1A1MAPK1MAPTPPARGPPARA
SCHEMBL19912668 0.76 HTRA1 (0.47) ALDH1A1MAPK1MAPTPPARGPPARA
SCHEMBL18039199 0.76 GRN (0.47) ALDH1A1GRNSORT1
SCHEMBL4612427 0.76 GRN (0.33) HPGDALDH1A1CARM1PRMT6OGG1
SCHEMBL4612394 0.76 GRN (0.33) HPGDL3MBTL1ALDH1A1CARM1PRMT6

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
EP-1567480-B1 N-ALKYNYL-2-(SUBSTITUTED PHENOXY) ALKYLAMIDES AND THEIR USE AS FUNGICIDES SYNGENTA LTD (GB) 2008-03-12 EP disclosed
US-7271130-B2 N-alkynyl-2-(substituted phenoxy) alkylamides and their use as fungicides SYNGENTA LIMITED (GB) 2007-09-18 US disclosed
US-20060194763-A1 N-alkynyl-2-(substituted phenoxy) alkylamides and their use as fungicides SYNGENTA LIMITED (GB) 2006-08-31 US disclosed
EP-1567480-A1 N-ALKYNYL-2-(SUBSTITUTED PHENOXY) ALKYLAMIDES AND THEIR USE AS FUNGICIDES Syngenta Limited (GB) 2005-08-31 EP disclosed
WO-2004048316-A1 N-ALKYNYL-2- (SUBSTITUTED PHENOXY) ALKYLAMIDES AND THEIR USE AS FUNGICIDES SYNGENTA LIMITED (GB) 2004-06-10 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-20060194763-A1 N-alkynyl-2-(substituted phenoxy) alkylamides and their use as fungicides CYP4X1, PRXL2A, CYP1A2 HPGD 4709/4885L3MBTL1 500/4885ALDH1A1 1112/4885

“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.