SCHEMBL21549977

SCHEMBL21549977

COC(=O)CC(=O)CC1CC1(F)F

nearest known ligand 0.37

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.37
MGAM O43451 1/20 0.37
SI P14410 1/20 0.37
MGAM2 Q2M2H8 1/20 0.37
NR1H2 P55055 1/20 0.35
TSHR P16473 3/20 0.34
EPHX2 P34913 4/20 0.33
HSD17B10 Q99714 1/20 0.32
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
BRD4 O60885 1/20 0.31
KDM4E B2RXH2 1/20 0.31
LMNA P02545 1/20 0.31
CA12 O43570 1/20 0.30
CA2 P00918 1/20 0.30
CA7 P43166 1/20 0.30
CA9 Q16790 1/20 0.30
CA14 Q9ULX7 1/20 0.30

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
SCHEMBL21535287 0.86 NR1H2 (0.40) GAAMGAMSIMGAM2NR1H2
SCHEMBL31704320 0.84 GAA (0.47) GAAMGAMSIMGAM2EPHX2
SCHEMBL31704162 0.78 GRM2 (0.36)
SCHEMBL12561079 0.73 SCN9A (0.34) GAAMGAMSIMGAM2TSHR
SCHEMBL18706931 0.72 MGAM (0.39) GAAMGAMSIMGAM2NR1H2
SCHEMBL3956402 0.71 MGAM (0.42) GAAMGAMSIMGAM2TSHR
SCHEMBL19014082 0.70
SCHEMBL31704125 0.69 NR1H2 (0.33) NR1H2TSHR
SCHEMBL27976 0.68 MGAM (0.61) GAAMGAMSIMGAM2TSHR
SCHEMBL1015355 0.68 KMT2A (0.42) GAAMGAMSIMGAM2TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025261608-A1 PESTICIDALLY-ACTIVE 2,2-DIHALOCYCLOPROPYL COMPOUNDS SYNGENTA CROP PROTECTION AG (CH) 2025-12-26 WO claimed
EP-4745125-A1 PESTICIDALLY-ACTIVE 2,2-DIHALOCYCLOPROPYL COMPOUNDS Syngenta Crop Protection AG (CH) 2026-05-20 EP disclosed
WO-2025261608-A1 PESTICIDALLY-ACTIVE 2,2-DIHALOCYCLOPROPYL COMPOUNDS SYNGENTA CROP PROTECTION AG (CH) 2025-12-26 WO disclosed
WO-2025214612-A1 PESTICIDALLY-ACTIVE 2,2-DIHALOCYCLOPROPYL COMPOUNDS SYNGENTA CROP PROTECTION AG (CH) 2025-10-16 WO disclosed
CN-110452235-B Fluorine-containing isoxazole compound and preparation method, pharmaceutical composition and application thereof 中国科学院上海药物研究所 2023-02-17 CN disclosed
CN-110452235-A Fluorine isoxazole class compound and preparation method thereof, pharmaceutical composition and purposes SHANGHAI INST MATERIA MEDICA CAS 2019-11-15 CN disclosed
WO-2019214656-A1 FLUORINE-CONTAINING ISOXAZOLE COMPOUND, PREPARATION METHOD THEREFOR, AND PHARMACEUTICAL COMPOSITION AND USE THEREOF 中国科学院上海药物研究所 (CN) 2019-11-14 WO disclosed