SCHEMBL25306629

SCHEMBL25306629

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

nearest known ligand 0.35

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
GRB2 P62993 1/20 0.35
CES2 O00748 2/20 0.34
NOTUM Q6P988 1/20 0.33
HTR6 P50406 1/20 0.32

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
SCHEMBL25308237 0.82 HTR6 (0.34) CES2NOTUMHTR6
SCHEMBL25299697 0.75 S1PR2 (0.41) GRB2CES2
SCHEMBL29115490 0.73 CES2 (0.62) CES2
SCHEMBL2480104 0.72 CES2 (0.37) CES2NOTUM
SCHEMBL5966766 0.71 CES2 (0.42) GRB2CES2
SCHEMBL30527948 0.71 PGK1 (0.39) CES2
SCHEMBL1759639 0.71 PGK1 (0.39) CES2
SCHEMBL25261666 0.71 KMT2A (0.40) GRB2
SCHEMBL3502473 0.70 GRB2 (0.49) GRB2CES2
SCHEMBL15957705 0.70 PGK1 (0.50) GRB2CES2NOTUM

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