SCHEMBL8524817

SCHEMBL8524817

Cc1sc(C(=O)CC(=O)C2CC2)c(F)c1F

nearest known ligand 0.34

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.31
ALOX15 P16050 1/20 0.31
ALDH1A1 P00352 1/20 0.30
MAPT P10636 1/20 0.30
HPGD P15428 1/20 0.30
MAPK1 P28482 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
SCHEMBL6443097 0.84 TP53 (0.30) TP53ALOX15
SCHEMBL8491839 0.79 TP53 (0.33) TP53ALOX15ALDH1A1MAPTHPGD
SCHEMBL8308302 0.68
SCHEMBL7705486 0.68 GSK3B (0.56) ALDH1A1
SCHEMBL8312398 0.67
SCHEMBL9019946 0.66 TAS1R3 (0.42)
SCHEMBL9019967 0.66 TAS1R3 (0.36)
SCHEMBL8309084 0.65 GSK3B (0.35)
SCHEMBL9242778 0.65
SCHEMBL25433576 0.62 L3MBTL1 (0.41) MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-1999003856-A1 4-BENZOYL-ISOXAZOLE- AND -PYRAZOLE DERIVATIVES AND 2-CYANO 1,3-DIONE DERIVATIVES AS HERBICIDES RHONE-POULENC AGRICULTURE LIMITED (GB) 1999-01-28 WO disclosed