SCHEMBL8488379

SCHEMBL8488379

CCOC(=O)c1noc(C2CC2)c1C(=O)c1ccc(Cl)cc1S(C)(=O)=O

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 3/20 0.38
GLP1R P43220 1/20 0.37
PPARG P37231 1/20 0.37
PPARD Q03181 1/20 0.37
PPARA Q07869 1/20 0.37
MAPT P10636 3/20 0.37
PTGS2 P35354 1/20 0.36
NPSR1 Q6W5P4 3/20 0.35
ALDH1A1 P00352 3/20 0.35
NPC1 O15118 2/20 0.35
MAPK1 P28482 2/20 0.35
TRPV1 Q8NER1 1/20 0.35
TP53 P04637 1/20 0.35
XBP1 P17861 1/20 0.35
HSD17B10 Q99714 1/20 0.35
TLR9 Q9NR96 1/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
KDM4E B2RXH2 1/20 0.35
HPGD P15428 1/20 0.35
TSHR P16473 2/20 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
SCHEMBL8493346 0.89 NR1H4 (0.38) PPARGPPARDPPARAMAPTALDH1A1
SCHEMBL8490660 0.89 TP53 (0.36) HTTMAPTALDH1A1TP53HSD17B10
SCHEMBL9117063 0.89 HTT (0.42) HTTMAPTNPSR1ALDH1A1NPC1
SCHEMBL8492955 0.88 ALDH1A1 (0.36) HTTGLP1RMAPTPTGS2NPSR1
SCHEMBL9116239 0.87 NR1H4 (0.35) PPARGPPARDPPARAALDH1A1SMN1; SMN2
SCHEMBL8493474 0.86 TSHR (0.37) HTTMAPTALDH1A1TP53HSD17B10
SCHEMBL6054776 0.86 MLYCD (0.38) HTTMAPTALDH1A1TP53
SCHEMBL8762913 0.86 SMURF2 (0.38) PPARGPPARDPPARANPC1
SCHEMBL7681339 0.85 MAPT (0.36) GLP1RPPARGPPARDPPARAMAPT
SCHEMBL9114894 0.85 PPARG (0.38) HTTPPARGPPARDPPARAMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5656573-A Herbicidal 4-substituted isoxazoles RHONE-POULENC AGRICULTURE LTD. (GB) 1997-08-12 US claimed
EP-0487357-B1 4 Benzoyl isoxazole derivatives RHONE POULENC AGRICULTURE (GB) 1997-07-02 EP claimed
EP-0487357-A1 4 Benzoyl isoxazole derivatives RHONE-POULENC AGRICULTURE LTD. (GB) 1992-05-27 EP claimed
US-5859283-A TERTIARY-BUTYL 3-CYCLOALKYL-3-OXOPROPIONATE RHONE-POULENC AGRICULTURE LIMITED (GB) 1999-01-12 US disclosed
US-5747424-A HEATING AN AROMATIC DIKETONE WITH A SALT OF HYDROXYLAMINE IN A SOLVENT RHONE-POULENC AGRICULTURE LTD. (GB) 1998-05-05 US disclosed
US-5656573-A Herbicidal 4-substituted isoxazoles RHONE-POULENC AGRICULTURE LTD. (GB) 1997-08-12 US disclosed
US-5650533-A Intermediates to herbicidal 4-substituted isoxazoles RHONE-POULENC AGRICULTURE LTD. (GB) 1997-07-22 US disclosed
EP-0487357-B1 4 Benzoyl isoxazole derivatives RHONE POULENC AGRICULTURE (GB) 1997-07-02 EP disclosed
WO-1995022903-A1 NEW PESTICIDAL METHOD RHONE-POULENC AGROCHIMIE (FR) 1995-08-31 WO disclosed
EP-0487357-A1 4 Benzoyl isoxazole derivatives RHONE-POULENC AGRICULTURE LTD. (GB) 1992-05-27 EP disclosed