SCHEMBL14697332

SCHEMBL14697332

NNCC(=O)NCc1ccccc1

nearest known ligand 0.61

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.61
KMT2A Q03164 4/20 0.59
MEN1 O00255 2/20 0.59
MCL1 Q07820 1/20 0.56
ALDH1A1 P00352 5/20 0.55
HPGD P15428 2/20 0.55
KDM4E B2RXH2 1/20 0.55
CA12 O43570 1/20 0.55
CA1 P00915 1/20 0.55
CA2 P00918 1/20 0.55
CA7 P43166 1/20 0.55
CYP2D6 P10635 2/20 0.55
CYP2C19 P33261 2/20 0.55
CYP1A2 P05177 1/20 0.55
CYP2C9 P11712 1/20 0.55
TSHR P16473 1/20 0.55
LMNA P02545 2/20 0.54
HTT P42858 1/20 0.54
IDO1 P14902 1/20 0.54

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
SCHEMBL6814215 0.83 CA12 (0.70) GAAKMT2AMEN1MCL1ALDH1A1
SCHEMBL25412009 0.82 GAA (0.63) GAAKMT2AMEN1MCL1ALDH1A1
SCHEMBL7749669 0.82 GAA (0.63) GAAKMT2AMEN1MCL1ALDH1A1
SCHEMBL26580966 0.81 AOC3 (0.64) GAAKMT2AMEN1MCL1ALDH1A1
SCHEMBL26581057 0.81 AOC3 (0.64) GAAKMT2AMEN1MCL1ALDH1A1
SCHEMBL3087061 0.81 GAA (0.73) GAAKMT2AMEN1MCL1ALDH1A1
SCHEMBL12765264 0.81 GAA (0.61) GAAKMT2AMEN1MCL1ALDH1A1
SCHEMBL25410244 0.81 GAA (0.61) GAAKMT2AMEN1MCL1ALDH1A1
SCHEMBL14511474 0.81 GAA (0.61) GAAKMT2AMEN1MCL1ALDH1A1
SCHEMBL9334106 0.80 GAA (0.56) GAAKMT2AMEN1MCL1ALDH1A1

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-2744784-A1 CARBAMOYLMETHOXY- AND CARBAMOYLMETHYLTHIO- AND CARBAMOYLMETHYLAMINO BENZAMIDES FOR COMBATING INVERTEBRATE PESTS BASF SE (DE) 2014-06-25 EP disclosed
CN-103889960-A Carbamoylmethoxy- and carbamoylmethylthio- and carbamoylmethylamino benzamides for combating invertebrate pests BASF SE 2014-06-25 CN disclosed
WO-2013024170-A1 CARBAMOYLMETHOXY- AND CARBAMOYLMETHYLTHIO- AND CARBAMOYLMETHYLAMINO BENZAMIDES FOR COMBATING INVERTEBRATE PESTS BASF SE (DE) 2013-02-21 WO disclosed