SCHEMBL25008752

SCHEMBL25008752

COCc1cc(C(=O)OC)n(-c2ncccc2Cl)n1

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SLC16A3 O15427 7/20 0.41
SLC16A1 P53985 6/20 0.41
CYP1A2 P05177 1/20 0.38
POLB P06746 1/20 0.38
CYP2C9 P11712 1/20 0.38
CYP2C19 P33261 1/20 0.38
KMT2A Q03164 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
KDM4E B2RXH2 1/20 0.38
MAPT P10636 1/20 0.38
HPGD P15428 1/20 0.38
MALT1 Q9UDY8 4/20 0.37
RBP4 P02753 1/20 0.37
MCTS1 Q9ULC4 1/20 0.37
DHODH Q02127 1/20 0.36
ALDH1A1 P00352 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
SCHEMBL2623669 0.89 MALT1 (0.39) SLC16A3SLC16A1CYP1A2POLBCYP2C9
SCHEMBL30234264 0.89 SLC16A3 (0.44) SLC16A3SLC16A1MCTS1
SCHEMBL340847 0.89 MALT1 (0.38) SLC16A3SLC16A1CYP1A2POLBCYP2C9
SCHEMBL25008759 0.89 SLC16A3 (0.44) SLC16A3SLC16A1MCTS1
SCHEMBL421559 0.89 MALT1 (0.38) SLC16A3SLC16A1CYP1A2POLBCYP2C9
SCHEMBL30206595 0.89 MALT1 (0.38) SLC16A3SLC16A1CYP1A2POLBCYP2C9
SCHEMBL341689 0.88 DHODH (0.38) SLC16A3SLC16A1CYP1A2POLBCYP2C9
SCHEMBL16014672 0.88 MALT1 (0.37) SLC16A3SLC16A1CYP1A2POLBCYP2C9
SCHEMBL384668 0.88 SLC16A3 (0.39) SLC16A3SLC16A1CYP1A2POLBCYP2C9
SCHEMBL28802119 0.87 ALDH1A1 (0.38) SLC16A3SLC16A1CYP1A2POLBCYP2C9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118076228-A Methods for controlling diamide-resistant pests and compounds thereof 先正达农作物保护股份公司 2024-05-24 CN disclosed
WO-2023012081-A1 METHOD FOR CONTROLLING DIAMIDE RESISTANT PESTS & COMPOUNDS THEREFOR SYNGENTA CROP PROTECTION AG (CH) 2023-02-09 WO disclosed