SCHEMBL25317498

SCHEMBL25317498

NC(=O)C1C(=O)N(c2ccc(F)c(F)c2F)CC1c1ccc(C(F)(F)F)cc1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RPS6KB1 P23443 1/20 0.35
MDM2 Q00987 1/20 0.34
GAA P10253 2/20 0.34
TDP1 Q9NUW8 2/20 0.34
SIRT2 Q8IXJ6 1/20 0.34
SIRT1 Q96EB6 1/20 0.34
FPR1 P21462 6/20 0.33
FPR2 P25090 6/20 0.33
AADAT Q8N5Z0 1/20 0.33
DPP4 P27487 1/20 0.33
KDM4E B2RXH2 1/20 0.33
ALDH1A1 P00352 1/20 0.33
POLB P06746 1/20 0.33
MAPK1 P28482 1/20 0.33
HTR2C P28335 1/20 0.33
KIF11 P52732 1/20 0.32
GSK3B P49841 1/20 0.32
CYP1A2 P05177 1/20 0.32
CYP3A4 P08684 1/20 0.32
CYP2D6 P10635 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
SCHEMBL25315680 0.90 SIRT2 (0.38) RPS6KB1GAATDP1SIRT2SIRT1
SCHEMBL25313489 0.87 RPS6KB1 (0.38) RPS6KB1FPR1FPR2AADATHTR2C
SCHEMBL21638335 0.85 SIRT2 (0.41) GAATDP1SIRT2SIRT1ALDH1A1
SCHEMBL25317840 0.80 HTR2B (0.38) RPS6KB1SIRT2SIRT1ALDH1A1MAPK1
SCHEMBL22493138 0.80 FPR1 (0.38) RPS6KB1GAATDP1SIRT2SIRT1
SCHEMBL22493136 0.77 RPS6KB1 (0.41) RPS6KB1FPR1FPR2HTR2C
SCHEMBL25313673 0.76 KDM1A (0.36) SIRT2SIRT1AADATHTR2C
SCHEMBL25894684 0.76 TACR1 (0.43) GAATDP1SIRT2SIRT1KDM4E
SCHEMBL25315349 0.75 HRH3 (0.37) DPP4
SCHEMBL25319499 0.74 ALDH1A1 (0.40) RPS6KB1SIRT2SIRT1ALDH1A1MAPK1

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
EP-3890487-B1 HERBICIDAL COMPOSITIONS SYNGENTA PARTICIPATIONS AG (CH) 2024-06-12 EP claimed
EP-3923724-B1 HERBICIDAL COMPOSITIONS SYNGENTA CROP PROTECTION AG (CH) 2023-07-26 EP claimed