SCHEMBL25308237

SCHEMBL25308237

NC(=O)C(F)(F)c1cc(Br)nc(Br)c1

nearest known ligand 0.34

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 1/20 0.34
CES2 O00748 1/20 0.33
NOTUM Q6P988 1/20 0.32
GAA P10253 1/20 0.32
KCNN4 O15554 2/20 0.32
CFTR P13569 1/20 0.31
KMT2A Q03164 1/20 0.31
PTPN1 P18031 1/20 0.31
KIF11 P52732 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
SCHEMBL25306629 0.82 GRB2 (0.35) HTR6CES2NOTUM
SCHEMBL22747508 0.71 CA1 (0.48) CES2KCNN4KMT2AKIF11
SCHEMBL2480104 0.71 CES2 (0.37) CES2NOTUMKIF11
SCHEMBL23326602 0.69 CA1 (0.54) CES2KCNN4KMT2AKIF11
SCHEMBL1579179 0.67 PARP1 (0.45) KMT2A
SCHEMBL22366863 0.67 MAPT (0.42) GAAKCNN4KMT2A
SCHEMBL28419175 0.67 MEN1 (0.48) HTR6GAAKMT2AKIF11
SCHEMBL23588020 0.66 KIF11 (0.55) CES2KCNN4KMT2APTPN1KIF11
SCHEMBL2465581 0.66 MAPT (0.56) CES2KCNN4KMT2APTPN1
SCHEMBL15612351 0.64 ALDH1A1 (0.43) KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118647270-A Novel derivatives of non-coding amino acids and their use as herbicides 福提费斯特有限公司 2024-09-13 CN claimed
WO-2023131951-A1 NOVEL DERIVATIVES OF NON-CODED AMINO ACIDS AND THEIR USE AS HERBICIDES FORTEPHEST LTD. (IL) 2023-07-13 WO claimed
CN-118647270-A Novel derivatives of non-coding amino acids and their use as herbicides 福提费斯特有限公司 2024-09-13 CN disclosed
WO-2023131951-A1 NOVEL DERIVATIVES OF NON-CODED AMINO ACIDS AND THEIR USE AS HERBICIDES FORTEPHEST LTD. (IL) 2023-07-13 WO disclosed