SCHEMBL1424846

SCHEMBL1424846

COC(=O)c1nc(CSC)cc(Cl)c1Cl

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
S1PR4 O95977 1/20 0.40
NPSR1 Q6W5P4 3/20 0.39
NQO2 P16083 5/20 0.36
KDM4E B2RXH2 2/20 0.36
PKM P14618 2/20 0.36
RCE1 Q9Y256 1/20 0.36
RXFP1 Q9HBX9 1/20 0.35
CYP1A2 P05177 1/20 0.34
CYP3A4 P08684 1/20 0.34
CYP2D6 P10635 1/20 0.34
CYP2C9 P11712 1/20 0.34
CYP2C19 P33261 1/20 0.34
L3MBTL1 Q9Y468 4/20 0.34
MRGPRX4 Q96LA9 1/20 0.34
MEN1 O00255 1/20 0.34
MAPT P10636 1/20 0.34
HTT P42858 1/20 0.34
KMT2A Q03164 1/20 0.34
ALDH1A1 P00352 2/20 0.33
DCTPP1 Q9H773 1/20 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
SCHEMBL1424888 0.86 NQO2 (0.40) S1PR4NPSR1NQO2KDM4EPKM
SCHEMBL1424166 0.82 NPSR1 (0.41) S1PR4NPSR1NQO2KDM4EPKM
SCHEMBL2133062 0.76 NPSR1 (0.48) S1PR4NPSR1NQO2KDM4EPKM
SCHEMBL3971796 0.72 NPSR1 (0.44) S1PR4NPSR1NQO2KDM4EPKM
SCHEMBL24984930 0.71 NPSR1 (0.42) S1PR4NPSR1NQO2KDM4EPKM
SCHEMBL3973268 0.70 NPSR1 (0.41) S1PR4NPSR1NQO2KDM4EPKM
SCHEMBL6166117 0.70 NPSR1 (0.41) S1PR4NPSR1NQO2KDM4EPKM
SCHEMBL6163871 0.69 NQO2 (0.49) NPSR1NQO2KDM4EMRGPRX4ALDH1A1
SCHEMBL16776828 0.69 NQO2 (0.43) S1PR4NPSR1NQO2KDM4EPKM
SCHEMBL16776874 0.69 NQO2 (0.43) S1PR4NPSR1NQO2KDM4EPKM

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-1608624-B1 6-ALKYL OR ALKENYL-4-AMINOPICOLINATES AND THEIR USE AS HERBICIDES DOW AGROSCIENCES LLC (US) 2011-03-23 EP disclosed
US-7432227-B2 6-alkyl or alkenyl-4-aminopicolinates and their use as herbicides DOW AGROSCIENCES LLC (US) 2008-10-07 US disclosed
EP-1608624-A2 6-ALKYL OR ALKENYL-4-AMINOPICOLINATES AND THEIR USE AS HERBICIDES Dow AgroSciences LLC (US) 2005-12-28 EP disclosed
WO-2004089906-A2 6-ALKYL OR ALKENYL-4-AMINOPICOLINATES AND THEIR USE AS HERBICIDES DOW AGROSCIENCES LLC (US) 2004-10-21 WO disclosed
US-20040198608-A1 6-Alkyl or alkenyl-4-aminopicolinates and their use as herbicides CORTEVA AGRISCIENCE LLC 2004-10-07 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 (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-20040198608-A1 6-Alkyl or alkenyl-4-aminopicolinates and their use as herbicides AADAC, AASDHPPT, AADAT S1PR4 3353/4885NPSR1 2922/4885NQO2 1172/4885

“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.