SCHEMBL7577830

SCHEMBL7577830

CS(=O)(=O)Cc1c(C(=O)c2cnoc2C2CC2)ccc(Cl)c1S(C)(=O)=O

nearest known ligand 0.32

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
DHODH Q02127 3/20 0.32
CXCR2 P25025 1/20 0.32
MEN1 O00255 2/20 0.31
KMT2A Q03164 2/20 0.31
MAPK1 P28482 1/20 0.31
NAMPT P43490 1/20 0.31
PDE2A O00408 1/20 0.30
NR1H4 Q96RI1 2/20 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
SCHEMBL7575598 0.89 DHODH (0.33) DHODHMEN1KMT2APDE2ANR1H4
SCHEMBL7573255 0.88 DHODH (0.32) DHODHMEN1KMT2APDE2ANR1H4
SCHEMBL7575354 0.87 DHODH (0.35) DHODHMEN1KMT2APDE2ANR1H4
SCHEMBL8891921 0.87 ALDH1A1 (0.34) NAMPTNR1H4
SCHEMBL8389669 0.86 DHODH (0.34) DHODHCXCR2MEN1KMT2ANAMPT
SCHEMBL7574569 0.85 DHODH (0.32) DHODHMAPK1PDE2A
SCHEMBL7572977 0.84 PDE4D (0.35) DHODHNR1H4
SCHEMBL7924451 0.84 DHODH (0.34) DHODHCXCR2MEN1KMT2ANAMPT
SCHEMBL8488330 0.83 PDE2A (0.36) DHODHCXCR2MEN1KMT2ANAMPT
SCHEMBL9115094 0.83 DHODH (0.34) DHODHCXCR2MEN1KMT2ANAMPT

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
EP-0609798-B1 4-Benzoyl isoxazoles and their use as herbicides AVENTIS AGRICULTURE LTD (GB) 2002-10-02 EP claimed