SCHEMBL24730862

SCHEMBL24730862

O=C(Nc1cc(NC(=O)[C@@H]2[C@@H](c3ccc(F)c(C(F)(F)F)c3)C2(Cl)Cl)ccc1Cl)c1cnc(F)c(F)c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KCNQ3 O43525 3/20 0.42
KCNQ2 O43526 3/20 0.42
KCNE1 P15382 3/20 0.42
KCNQ1 P51787 3/20 0.42
MEN1 O00255 5/20 0.39
KMT2A Q03164 5/20 0.39
LMNA P02545 3/20 0.39
GRM4 Q14833 1/20 0.38
MAPT P10636 1/20 0.37
MAPK1 P28482 1/20 0.37
BRAF P15056 6/20 0.37
KDR P35968 3/20 0.37
NPSR1 Q6W5P4 1/20 0.36
HTR2A P28223 1/20 0.36
CCR2 P41597 1/20 0.36
CCR5 P51681 1/20 0.36
ALDH1A1 P00352 1/20 0.36
RECQL P46063 1/20 0.36
KIT P10721 1/20 0.34
FLT3 P36888 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
SCHEMBL24730160 1.00 KCNQ3 (0.42) KCNQ3KCNQ2KCNE1KCNQ1MEN1
SCHEMBL24730868 1.00 KCNQ3 (0.42) KCNQ3KCNQ2KCNE1KCNQ1MEN1
SCHEMBL29948485 0.87 MEN1 (0.44) KCNQ3KCNQ2KCNE1KCNQ1MEN1
SCHEMBL24730838 0.86 KCNQ3 (0.41) KCNQ3KCNQ2KCNE1KCNQ1MEN1
SCHEMBL24730178 0.84 MEN1 (0.40) KCNQ3KCNQ2KCNE1KCNQ1MEN1
SCHEMBL29948319 0.84 MEN1 (0.40) KCNQ3KCNQ2KCNE1KCNQ1MEN1
SCHEMBL29948564 0.84 MEN1 (0.40) KCNQ3KCNQ2KCNE1KCNQ1MEN1
SCHEMBL24730173 0.84 MEN1 (0.40) KCNQ3KCNQ2KCNE1KCNQ1MEN1
SCHEMBL24730172 0.84 MEN1 (0.40) KCNQ3KCNQ2KCNE1KCNQ1MEN1
SCHEMBL24730151 0.83 KCNQ3 (0.46) KCNQ3KCNQ2KCNE1KCNQ1MEN1

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-4313939-A1 MOLECULES HAVING PESTICIDAL UTILITY AND INTERMEDIATES AND PROCESSES RELATED THERETO Corteva Agriscience LLC (US) 2024-02-07 EP disclosed
WO-2022204080-A1 MOLECULES HAVING PESTICIDAL UTILITY AND INTERMEDIATES AND PROCESSES RELATED THERETO CORTEVA AGRISCIENCE LLC (US) 2022-09-29 WO disclosed
WO-2022204080-A1 MOLECULES HAVING PESTICIDAL UTILITY AND INTERMEDIATES AND PROCESSES RELATED THERETO CORTEVA AGRISCIENCE LLC (US) 2022-09-29 WO disclosed