SCHEMBL7573447

SCHEMBL7573447

CSc1c(Cl)ccc(C(=O)c2cnoc2C2CC2)c1C[S+](C)[O-]

nearest known ligand 0.31

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
PDE2A O00408 1/20 0.31
DHODH Q02127 2/20 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
SCHEMBL7573986 0.88 PDE2A (0.33) PDE2ADHODH
SCHEMBL7575155 0.87 PDE2A (0.33) PDE2ADHODH
SCHEMBL7583005 0.87 DHODH (0.32) PDE2ADHODH
SCHEMBL7575732 0.86 ALDH1A1 (0.32) PDE2ADHODH
SCHEMBL7577500 0.86 PDE2A (0.32) PDE2ADHODH
SCHEMBL7573455 0.86 DHODH (0.34) PDE2ADHODH
SCHEMBL27294090 0.86 PDE2A (0.34) PDE2ADHODH
SCHEMBL27288096 0.85 PDE2A (0.32) PDE2ADHODH
SCHEMBL8890990 0.84 NR1H4 (0.33)
SCHEMBL8752743 0.84 DHODH (0.36) PDE2ADHODH

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