SCHEMBL3326161

SCHEMBL3326161

COC(=O)c1nc(-c2csc(C)n2)cc(NC(C)=O)c1Cl

nearest known ligand 0.42

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.42
NPC1 O15118 3/20 0.41
POLB P06746 1/20 0.39
ALDH1A1 P00352 2/20 0.39
ABL1 P00519 5/20 0.38
GRM5 P41594 1/20 0.37
KDM4A O75164 1/20 0.36
KDM4B O94953 1/20 0.36
KDM5C P41229 1/20 0.36
KDM5B Q9UGL1 1/20 0.36
RAB9A P51151 2/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
KDM4E B2RXH2 1/20 0.36
PFKFB3 Q16875 1/20 0.36
PFKFB4 Q16877 1/20 0.36
ECE1 P42892 1/20 0.36

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
SCHEMBL3330319 0.83 KDM4E (0.41) MAPTNPC1POLBALDH1A1KDM4A
SCHEMBL2467108 0.78 ADORA3 (0.53) MAPTNPC1POLBALDH1A1RAB9A
SCHEMBL20727067 0.78 ALDH1A1 (0.47) MAPTPOLBALDH1A1MEN1KMT2A
SCHEMBL3327361 0.78 ALDH1A1 (0.46) MAPTPOLBALDH1A1ABL1MEN1
SCHEMBL3328010 0.78 AGER (0.45) MAPTALDH1A1MEN1KMT2A
SCHEMBL2467820 0.78 ADORA2A (0.53) MAPTALDH1A1MEN1KMT2AKDM4E
SCHEMBL2469495 0.77 ADORA3 (0.53) MAPTNPC1ALDH1A1ABL1RAB9A
SCHEMBL3327634 0.77 ALDH1A1 (0.40) MAPTNPC1POLBALDH1A1ABL1
SCHEMBL32669001 0.76 ALDH1A1 (0.48) MAPTALDH1A1KDM4E
SCHEMBL2338797 0.76 ALDH1A1 (0.48) MAPTALDH1A1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8962523-B2 Herbicide/safener combination BAYER CROPSCIENCE AG (DE) 2015-02-24 US disclosed
US-20150051074-A1 HERBICIDE/SAFENER COMBINATION BAYER CROPSCIENCE AG (DE) 2015-02-19 US disclosed
US-20100137137-A1 HERBICIDE/SAFENER COMBINATION BAYER CROPSCIENCE AG (DE) 2010-06-03 US disclosed
EP-1414814-B1 6-ARYL-4-AMINOPICOLINATES AND THEIR USE AS HERBICIDES DOW AGROSCIENCES LLC (US) 2005-02-02 EP disclosed
US-6784137-B2 SUCH AS 5,6-DICHLOROPYRIDINE-2-CARBOXYLIC ACID-N-OXIDE FOR PREEMERGENCE APPLICATION DOW AGROSCIENCES LLC 2004-08-31 US disclosed
EP-1414814-A1 6-ARYL-4-AMINOPICOLINATES AND THEIR USE AS HERBICIDES Dow Agrosciences LLC (US) 2004-05-06 EP disclosed
US-20030114311-A1 6-Aryl-4-aminopicolinates and their use as herbicides CORTEVA AGRISCIENCE LLC 2003-06-19 US disclosed
WO-2003011853-A1 6-ARYL-4-AMINOPICOLINATES AND THEIR USE AS HERBICIDES DOW AGROSCIENCES LLC (US) 2003-02-13 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 (3 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-20100137137-A1 HERBICIDE/SAFENER COMBINATION DDT, CYP2W1, GAP43 MAPT 4056/4885NPC1 4575/4885POLB 2379/4885
US-20030114311-A1 6-Aryl-4-aminopicolinates and their use as herbicides AADAC, DDT, AADAT MAPT 526/4885NPC1 3789/4885POLB 4803/4885
US-20150051074-A1 HERBICIDE/SAFENER COMBINATION DDT, CYP2W1, GAP43 MAPT 4056/4885NPC1 4575/4885POLB 2379/4885

“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.