SCHEMBL8747768

SCHEMBL8747768

COC(=O)c1ccc(Cl)c(F)c1CN(C)S(C)(=O)=O

nearest known ligand 0.47

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.47
MCOLN3 Q8TDD5 1/20 0.47
TSHR P16473 2/20 0.41
ALDH1A1 P00352 1/20 0.41
KMT2A Q03164 2/20 0.41
LMNA P02545 2/20 0.36
MEN1 O00255 1/20 0.36
SMN1; SMN2 Q16637 3/20 0.36
CYP1A2 P05177 1/20 0.36
CYP2C19 P33261 1/20 0.36
MAPT P10636 4/20 0.36
KDM4E B2RXH2 2/20 0.36
ABL1 P00519 1/20 0.35
HSD17B10 Q99714 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
NPC1 O15118 1/20 0.34
MEP1B Q16820 1/20 0.34
PDE3B Q13370 1/20 0.34
PDE3A Q14432 1/20 0.34

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
SCHEMBL8747897 0.90 POLB (0.50) POLBMCOLN3TSHRALDH1A1KMT2A
SCHEMBL8747757 0.87 POLB (0.47) POLBMCOLN3TSHRALDH1A1KMT2A
SCHEMBL3437024 0.85 LMNA (0.40) POLBMCOLN3ALDH1A1KMT2ALMNA
SCHEMBL8747960 0.80 POLB (0.43) POLBMCOLN3TSHRALDH1A1KMT2A
SCHEMBL8754861 0.79 POLB (0.35) POLBMCOLN3TSHRALDH1A1KMT2A
SCHEMBL27455854 0.78 POLB (0.42) POLBMCOLN3TSHRALDH1A1KMT2A
SCHEMBL8747840 0.76 ABL1 (0.41) POLBMCOLN3TSHRALDH1A1KMT2A
SCHEMBL8748143 0.75 POLB (0.50) POLBMCOLN3TSHRALDH1A1KMT2A
SCHEMBL8747754 0.75 KMT2A (0.43) POLBMCOLN3ALDH1A1KMT2ASMN1; SMN2
SCHEMBL8754700 0.72 CYP11B1 (0.34) POLBMCOLN3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1148385-A 4-benzoylisoxazole derivatives and their use as herbicides RHONE POULENC AGRICULTURE (GB) 1997-04-23 CN disclosed
EP-0759911-A1 4-BENZOYLISOXAZOLE DERIVATIVES AND THEIR USE AS HERBICIDES RHONE POULENC AGRICULTURE LTD. (GB) 1997-03-05 EP disclosed
WO-1995031446-A1 4-BENZOYLISOXAZOLE DERIVATIVES AND THEIR USE AS HERBICIDES RHONE POULENC AGRICULTURE LTD. (GB) 1995-11-23 WO disclosed