SCHEMBL8389458

SCHEMBL8389458

CS(=O)(=O)C1C(Cl)=C(C2CC2)ON1C(=O)c1ccccc1C(F)(F)F

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MGLL Q99685 2/20 0.41
CYP2C9 P11712 1/20 0.39
CYP2C19 P33261 1/20 0.39
HTR2B P41595 1/20 0.39
MAPK14 Q16539 1/20 0.39
SLC6A2 P23975 1/20 0.38
SLC6A4 P31645 1/20 0.38
RBP4 P02753 2/20 0.36
P2RX7 Q99572 2/20 0.36
CCR5 P51681 1/20 0.35
HSD11B1 P28845 1/20 0.35
NPY2R P49146 1/20 0.35
PSEN1 P49768 1/20 0.35
PSEN2 P49810 1/20 0.35
APH1B Q8WW43 1/20 0.35
NCSTN Q92542 1/20 0.35
APH1A Q96BI3 1/20 0.35
PSENEN Q9NZ42 1/20 0.35
PTGES O14684 1/20 0.35

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
SCHEMBL8391795 0.89 CYP2C9 (0.39) MGLLCYP2C9CYP2C19HTR2BMAPK14
SCHEMBL8390891 0.80 MGLL (0.43) MGLLCYP2C9CYP2C19HTR2BMAPK14
SCHEMBL8489221 0.73 SLC9A1 (0.40) MGLL
SCHEMBL8388424 0.71 MGLL (0.42) MGLLCYP2C9CYP2C19MAPK14CCR5
SCHEMBL8494381 0.65 LMNA (0.37) MGLL
SCHEMBL8494772 0.62 CNR2 (0.36) MGLLCYP2C9CYP2C19HTR2BMAPK14
SCHEMBL13282181 0.61 MGLL (0.44) MGLLCYP2C9CYP2C19HTR2BMAPK14
SCHEMBL21740905 0.61 CYP2C9 (0.63) MGLLCYP2C9CYP2C19HTR2BMAPK14
SCHEMBL8606607 0.61 LMNA (0.43) MGLL
SCHEMBL4618974 0.60 CYP2C9 (0.66) MGLLCYP2C9CYP2C19HTR2BMAPK14

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
US-5856274-A 4-benzoyl isoxazoles and their use as herbicides RHONE-POULENC AGRICULTURE LIMITED (GB) 1999-01-05 US disclosed