SCHEMBL4549453

SCHEMBL4549453

O=[N+]([O-])c1ccc(/C(Cl)=N/Nc2ccc(OC(F)(F)F)cc2)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 16/20 0.47
KMT2A Q03164 13/20 0.47
MEN1 O00255 12/20 0.47
HTT P42858 6/20 0.47
NPSR1 Q6W5P4 3/20 0.47
TP53 P04637 2/20 0.47
CASP3 P42574 1/20 0.47
SENP7 Q9BQF6 1/20 0.47
ALDH1A1 P00352 10/20 0.47
GAA P10253 7/20 0.47
MAPK1 P28482 2/20 0.47
GFER P55789 2/20 0.47
SMN1; SMN2 Q16637 7/20 0.47
TDP1 Q9NUW8 3/20 0.47
CYP3A4 P08684 2/20 0.47
ALOX15 P16050 1/20 0.47
TSHR P16473 1/20 0.47
BLM P54132 1/20 0.47
HIF1A Q16665 1/20 0.47
HSD17B10 Q99714 1/20 0.47

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
SCHEMBL16039766 1.00 MAPT (0.47) MAPTKMT2AMEN1HTTNPSR1
SCHEMBL28732433 0.83 KMT2A (0.48) MAPTKMT2AMEN1HTTNPSR1
SCHEMBL16039451 0.82 EPHX2 (0.58) MAPTKMT2AMEN1NPSR1TP53
SCHEMBL16039450 0.82 EPHX2 (0.58) MAPTKMT2AMEN1NPSR1TP53
SCHEMBL16039616 0.81 MAPT (0.50) MAPTKMT2AMEN1NPSR1TP53
SCHEMBL16084137 0.81 MAPT (0.50) MAPTKMT2AMEN1NPSR1TP53
SCHEMBL16039617 0.81 MAPT (0.50) MAPTKMT2AMEN1NPSR1TP53
SCHEMBL19244894 0.80 MAPT (0.70) MAPTKMT2AMEN1HTTNPSR1
SCHEMBL4549465 0.80 MAPT (0.49) MAPTKMT2AMEN1NPSR1TP53
SCHEMBL31483978 0.79 MAPT (0.60) MAPTKMT2AMEN1HTTNPSR1

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-9212150-B2 Process for the preparation of certain triaryl pesticide intermediates DOW AGROSCIENCES LLC (US) 2015-12-15 US disclosed
WO-2014163933-A1 PROCESS FOR PREPARATION OF TRIARYL PESTICIDE INTERMEDIATE DOW AGROSCIENCES LLC (US) 2014-10-09 WO disclosed
US-20140275557-A1 PROCESS FOR THE PREPARATION OF CERTAIN TRIARYL PESTICIDE INTERMEDIATES DOW AGROSCIENCES LLC (US) 2014-09-18 US disclosed
US-8178658-B2 Insecticide (against arthropods), nematocide; use against pesticide-resistant pests; use on plants and animals; Compounds are tetrahydropyrans substituted with an aryl-heteroaryl-aryl-containing group DOW AGROSCIENCES, LLC (US) 2012-05-15 US disclosed
US-20090209476-A1 Insecticide (against arthropods), nematocide; use against pesticide-resistant pests; use on plants and animals; Compounds are tetrahydropyrans substituted with an aryl-heteroaryl-aryl-containing group DOW AGROSCIENCES LLC (US) 2009-08-20 US 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-20090209476-A1 Insecticide (against arthropods), nematocide; use against pesticide-resistant pests; use on plants and animals; Compounds are tetrahydropyrans substituted with an aryl-heteroaryl-aryl-containing group DDT, ACHE, NANP MAPT 2297/4885KMT2A 2528/4885MEN1 4826/4885
US-20140275557-A1 PROCESS FOR THE PREPARATION OF CERTAIN TRIARYL PESTICIDE INTERMEDIATES DDT, POR, CYP4F3 MAPT 4059/4885KMT2A 1642/4885MEN1 3040/4885

“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.