SCHEMBL45319

SCHEMBL45319

COC(=O)c1cc(OC(=O)O)nn1-c1ncccc1Cl

nearest known ligand 0.41

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MALT1 Q9UDY8 6/20 0.37
RBP4 P02753 1/20 0.37
TRPA1 O75762 4/20 0.36
ALDH1A1 P00352 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
TRPV1 Q8NER1 1/20 0.35
SLC16A3 O15427 1/20 0.35
SLC16A1 P53985 1/20 0.35
DHODH Q02127 1/20 0.35
ALOX15 P16050 1/20 0.34
HTT P42858 1/20 0.34

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
SCHEMBL45318 0.84 KMT2A (0.41) MALT1RBP4ALDH1A1
SCHEMBL384694 0.84 ALDH1A1 (0.45) MALT1RBP4ALDH1A1SMN1; SMN2ALOX15
SCHEMBL17417246 0.83 MALT1 (0.36) MALT1RBP4ALDH1A1
SCHEMBL17417244 0.83 ALDH1A1 (0.37) MALT1RBP4ALDH1A1
SCHEMBL23249321 0.82 DHODH (0.45) MALT1RBP4ALDH1A1DHODHALOX15
SCHEMBL29504162 0.82 DHODH (0.45) MALT1RBP4ALDH1A1DHODHALOX15
SCHEMBL44760 0.82 MALT1 (0.39) MALT1RBP4TRPA1ALDH1A1SMN1; SMN2
SCHEMBL24948908 0.81 MALT1 (0.35) MALT1RBP4TRPA1TRPV1DHODH
SCHEMBL2586280 0.81 MALT1 (0.40) MALT1RBP4TRPA1SLC16A3SLC16A1
SCHEMBL45109 0.80 MALT1 (0.38) MALT1RBP4TRPA1ALDH1A1DHODH

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2582688-B1 ANTHRANILIC ACID DIAMIDE DERIVATIVES BAYER IP GMBH (DE) 2015-10-07 EP disclosed
EP-2582688-A1 ANTHRANILIC ACID DIAMIDE DERIVATIVES Bayer Intellectual Property GmbH (DE) 2013-04-24 EP disclosed
WO-2011157654-A1 ANTHRANILIC ACID DIAMIDE DERIVATIVES BAYER CROPSCIENCE AG (DE) 2011-12-22 WO disclosed