SCHEMBL29028501

SCHEMBL29028501

COCCN(C(=O)c1ccc(F)cc1)c1cccc(C(=O)Nc2c(Br)cc(C(F)(C(F)(F)F)C(F)(F)F)cc2C(F)(F)F)c1F

nearest known ligand 0.34

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
GPBAR1 Q8TDU6 2/20 0.34
PTGES O14684 4/20 0.34
RXFP1 Q9HBX9 3/20 0.32
HDAC8 Q9BY41 1/20 0.32
ADORA2A P29274 1/20 0.32
ADORA2B P29275 1/20 0.32
ADORA1 P30542 1/20 0.32
NAMPT P43490 2/20 0.31
GAA P10253 1/20 0.31
ALOX12 P18054 1/20 0.31
KDM4E B2RXH2 1/20 0.31
HPGD P15428 1/20 0.31
EPHX2 P34913 1/20 0.31

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
SCHEMBL29114027 0.95 PTGES (0.33) GPBAR1PTGESRXFP1HDAC8KDM4E
SCHEMBL29114041 0.95 GPBAR1 (0.36) GPBAR1PTGESRXFP1HDAC8KDM4E
SCHEMBL29028658 0.94 PTGES (0.36) GPBAR1PTGESRXFP1HDAC8KDM4E
SCHEMBL29028342 0.93 CTSS (0.34) PTGESHDAC8KDM4E
SCHEMBL29114030 0.92 RXFP1 (0.35) GPBAR1PTGESRXFP1KDM4E
SCHEMBL29114033 0.91 PTGES (0.34) GPBAR1PTGESRXFP1HDAC8KDM4E
SCHEMBL29114042 0.90 CTSS (0.33) PTGESRXFP1HDAC8HPGD
SCHEMBL29114034 0.90 PTGES (0.35) GPBAR1PTGESRXFP1KDM4EHPGD
SCHEMBL29114036 0.89 CTSS (0.34) PTGESRXFP1HDAC8KDM4EHPGD
SCHEMBL29114043 0.88 CTSS (0.35) GPBAR1PTGESRXFP1HDAC8HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4610251-A1 HEPTAFLUOROISOPROPYL-CONTAINING BISAMIDE COMPOUND AND INTERMEDIATE COMPOUND THEREOF, AND PREPARATION METHODS THEREFOR AND USE THEREOF Zhejiang Udragon Pesticides And Chemicals Co., Ltd. (CN) 2025-09-03 EP disclosed
WO-2025090578-A1 HETEROCYCLIC HYDRAZONES AS NEMATICIDES FMC CORPORATION (US) 2025-05-01 WO disclosed
CN-116947679-A Bisamide compound containing sevoflurane isopropyl, and preparation method and application thereof 浙江宇龙药业有限公司 2023-10-27 CN disclosed
CN-115925576-B Bisamide compound containing sevoflurane isopropyl, and preparation method and application thereof 浙江宇龙药业有限公司 2023-08-08 CN disclosed
CN-115974717-A Heptafluoroisopropyl-containing bisamide compound and intermediate compound thereof, and preparation method and application thereof 浙江宇龙药业有限公司 2023-04-18 CN disclosed