SCHEMBL7573465

SCHEMBL7573465

CS(=O)(=O)Cc1cc(S(C)(=O)=O)ccc1C(=O)c1cnoc1C1CC1

nearest known ligand 0.33

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
DHODH Q02127 3/20 0.33
MAPK1 P28482 3/20 0.33
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
KIF18A Q8NI77 2/20 0.32
PDE2A O00408 1/20 0.32
HRH4 Q9H3N8 2/20 0.31
NPC1 O15118 1/20 0.31
PNMT P11086 1/20 0.31
LMNA P02545 1/20 0.31
KDM2B Q8NHM5 1/20 0.31
P2RX7 Q99572 1/20 0.31
CRACR2A Q9BSW2 1/20 0.31

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
SCHEMBL8495014 0.91 DHODH (0.34) DHODHMEN1KMT2AKIF18APDE2A
SCHEMBL6054845 0.87 DHODH (0.33) DHODHMAPK1PDE2A
SCHEMBL7573670 0.87 SLC6A9 (0.35) DHODHPDE2ALMNA
SCHEMBL8890658 0.86 PTGS2 (0.40) MAPK1MEN1KMT2A
SCHEMBL7575701 0.85 HCRTR2 (0.40) DHODHPDE2ALMNA
SCHEMBL7576300 0.85 DHODH (0.46) DHODHMEN1KMT2ANPC1LMNA
SCHEMBL8891685 0.84 PTGS2 (0.38) MAPK1MEN1KMT2A
SCHEMBL8891642 0.84 ALDH1A1 (0.39) MAPK1MEN1KMT2A
SCHEMBL8683983 0.84 DHODH (0.36) DHODHKMT2AKIF18APDE2ANPC1
SCHEMBL8493300 0.84 DHODH (0.36) DHODHKIF18APDE2ANPC1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0609798-B1 4-Benzoyl isoxazoles and their use as herbicides AVENTIS AGRICULTURE LTD (GB) 2002-10-02 EP claimed
EP-0609798-A1 4-Benzoyl isoxazoles and their use as herbicides RHONE POULENC AGRICULTURE LTD. (GB) 1994-08-10 EP claimed
EP-0609798-B1 4-Benzoyl isoxazoles and their use as herbicides AVENTIS AGRICULTURE LTD (GB) 2002-10-02 EP disclosed
US-5374606-A Pre- and postemergence RHONE-POULENC AGRICULTURE LIMITED (GB) 1994-12-20 US disclosed
EP-0609798-A1 4-Benzoyl isoxazoles and their use as herbicides RHONE POULENC AGRICULTURE LTD. (GB) 1994-08-10 EP disclosed