SCHEMBL29025591

SCHEMBL29025591

FC(F)C(F)(F)Oc1cc(Cl)c(OCCCOc2ccc(C(F)(F)F)cn2)c(Cl)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.41
L3MBTL1 Q9Y468 2/20 0.39
MAPK1 P28482 1/20 0.39
RXRA P19793 2/20 0.37
GRIN1 Q05586 2/20 0.37
GRIN2B Q13224 2/20 0.37
THRB P10828 1/20 0.37
MRGPRX4 Q96LA9 1/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
TSHR P16473 1/20 0.36
HPGD P15428 1/20 0.35
GABRA5 P31644 1/20 0.34
MAPT P10636 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
LMNA P02545 2/20 0.34
LIPE Q05469 2/20 0.34
SCN9A Q15858 2/20 0.34
MEN1 O00255 1/20 0.34
POLB P06746 1/20 0.34
TDP1 Q9NUW8 1/20 0.33

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
SCHEMBL29025578 0.90 KMT2A (0.38) KMT2AL3MBTL1MAPK1RXRAGRIN1
SCHEMBL29025587 0.86 KMT2A (0.41) KMT2AL3MBTL1MAPK1RXRAGRIN1
SCHEMBL29025588 0.85 KMT2A (0.41) KMT2AL3MBTL1MAPK1RXRAGRIN1
SCHEMBL29025570 0.84 SMN1; SMN2 (0.46) KMT2AL3MBTL1MAPK1THRBMRGPRX4
SCHEMBL29025477 0.83 KMT2A (0.39) KMT2AL3MBTL1MAPK1RXRAGRIN1
SCHEMBL29025481 0.82 SMN1; SMN2 (0.43) KMT2AL3MBTL1MAPK1MRGPRX4SMN1; SMN2
SCHEMBL7071031 0.82 KMT2A (0.46) KMT2AL3MBTL1MAPK1RXRAGRIN1
SCHEMBL29025582 0.80 TDP1 (0.34) KMT2AL3MBTL1MAPK1SMN1; SMN2HPGD
SCHEMBL6671794 0.80 MRGPRX4 (0.49) KMT2AL3MBTL1MAPK1MRGPRX4SMN1; SMN2
SCHEMBL7073751 0.79 MRGPRX4 (0.47) KMT2AL3MBTL1MAPK1RXRAGRIN1

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-116178249-B Ether derivative with insecticidal and acaricidal activities as well as preparation method and application thereof 北京亦农生物科技有限公司 2024-02-09 CN disclosed
CN-116178249-A Ether derivative with insecticidal and acaricidal activities as well as preparation method and application thereof 北京亦农生物科技有限公司 2023-05-30 CN disclosed