SCHEMBL2599666

SCHEMBL2599666

C=Cc1c(C(=O)OC)nc(Cl)c(Cl)c1N

nearest known ligand 0.45

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 4/20 0.45
MAPT P10636 2/20 0.45
ATM Q13315 2/20 0.45
LMNA P02545 1/20 0.45
GAA P10253 1/20 0.45
TDP1 Q9NUW8 1/20 0.44
NPSR1 Q6W5P4 1/20 0.40
KDM4E B2RXH2 3/20 0.39
ALDH1A1 P00352 3/20 0.39
PKM P14618 2/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
NQO2 P16083 4/20 0.35
F2 P00734 1/20 0.35
RCE1 Q9Y256 1/20 0.34
ABL1 P00519 1/20 0.33
PTGS1 P23219 1/20 0.33
PTGS2 P35354 1/20 0.33
HPGD P15428 1/20 0.32
HSD17B10 Q99714 1/20 0.32

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
SCHEMBL2599586 0.85 NPSR1 (0.38) L3MBTL1MAPTATMLMNAGAA
SCHEMBL1614180 0.82 TDP1 (0.63) L3MBTL1MAPTATMLMNAGAA
SCHEMBL29512558 0.82 TDP1 (0.63) L3MBTL1MAPTATMLMNAGAA
SCHEMBL12182764 0.81 L3MBTL1 (0.42) L3MBTL1MAPTATMLMNAGAA
SCHEMBL11026002 0.81 TDP1 (0.62) L3MBTL1MAPTATMLMNAGAA
SCHEMBL11023076 0.77 NPSR1 (0.48) L3MBTL1MAPTATMLMNAGAA
SCHEMBL1917750 0.77 NPSR1 (0.41) L3MBTL1MAPTGAANPSR1KDM4E
SCHEMBL16776866 0.77 NPSR1 (0.41) L3MBTL1MAPTATMLMNAGAA
SCHEMBL14354045 0.76 TDP1 (0.47) L3MBTL1MAPTATMLMNAGAA
SCHEMBL2599585 0.76 TDP1 (0.47) L3MBTL1MAPTATMLMNAGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8835409-B2 3-alkenyl-6-halo-4-aminopicolinates and their use as herbicides DOW AGROSCIENCES, LLC. (US) 2014-09-16 US disclosed
US-8835409-B2 3-alkenyl-6-halo-4-aminopicolinates and their use as herbicides DOW AGROSCIENCES, LLC. (US) 2014-09-16 US disclosed
US-8835409-B2 3-alkenyl-6-halo-4-aminopicolinates and their use as herbicides DOW AGROSCIENCES, LLC. (US) 2014-09-16 US disclosed
EP-2571852-A1 CHEMICAL COMPOUNDS Syngenta Limited (GB) 2013-03-27 EP disclosed
US-20130065757-A1 CHEMICAL COMPOUNDS SYNGENTA LIMITED (GB) 2013-03-14 US disclosed
US-20130065757-A1 CHEMICAL COMPOUNDS SYNGENTA LIMITED (GB) 2013-03-14 US disclosed
US-20130065757-A1 CHEMICAL COMPOUNDS SYNGENTA LIMITED (GB) 2013-03-14 US disclosed
US-20120190548-A1 3-ALKENYL-6-HALO-4-AMINOPICOLINATES AND THEIR USE AS HERBICIDES DOW AGROSCIENCES LLC (US) 2012-07-26 US disclosed
US-20120190548-A1 3-ALKENYL-6-HALO-4-AMINOPICOLINATES AND THEIR USE AS HERBICIDES DOW AGROSCIENCES LLC (US) 2012-07-26 US disclosed
US-20120190548-A1 3-ALKENYL-6-HALO-4-AMINOPICOLINATES AND THEIR USE AS HERBICIDES DOW AGROSCIENCES LLC (US) 2012-07-26 US disclosed
WO-2011144891-A1 CHEMICAL COMPOUNDS SYNGENTA LIMITED (GB) 2011-11-24 WO disclosed
WO-2011144891-A1 CHEMICAL COMPOUNDS SYNGENTA LIMITED (GB) 2011-11-24 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-20130065757-A1 CHEMICAL COMPOUNDS HPD, PPOX, PIN1 L3MBTL1 3375/4885MAPT 2450/4885ATM 4359/4885
US-20120190548-A1 3-ALKENYL-6-HALO-4-AMINOPICOLINATES AND THEIR USE AS HERBICIDES ATL3, AAAS, HDHD5 L3MBTL1 409/4885MAPT 961/4885ATM 3960/4885

“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.