SCHEMBL7573992

SCHEMBL7573992

CSCc1cc(F)ccc1C(=O)c1cnoc1C1CC1

nearest known ligand 0.36

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
DHODH Q02127 3/20 0.36
PTGDR2 Q9Y5Y4 3/20 0.35
DPP4 P27487 1/20 0.32
DPP9 Q86TI2 1/20 0.32
DPP7 Q9UHL4 1/20 0.32
PDE2A O00408 1/20 0.32
HPGD P15428 1/20 0.32
EPHX2 P34913 1/20 0.32
FFAR4 Q5NUL3 2/20 0.32
P2RX7 Q99572 2/20 0.31
ALDH1A1 P00352 1/20 0.31
CRACR2A Q9BSW2 2/20 0.31
S100A4 P26447 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
SCHEMBL9116196 0.91 DHODH (0.36) DHODHPTGDR2DPP4DPP9DPP7
SCHEMBL7573020 0.87 DHODH (0.47) DHODHPTGDR2CRACR2A
SCHEMBL6558596 0.86 DHODH (0.34) DHODHPDE2AHPGDS100A4
SCHEMBL7573639 0.86 PTGDR2 (0.35) DHODHPTGDR2PDE2AHPGDFFAR4
SCHEMBL7576529 0.86 HPGD (0.34) DHODHPDE2AHPGDALDH1A1S100A4
SCHEMBL7577691 0.85 DHODH (0.36) DHODHPDE2AHPGDEPHX2ALDH1A1
SCHEMBL9115529 0.84 DHODH (0.49) DHODHPDE2AEPHX2FFAR4
SCHEMBL27285278 0.83 DHODH (0.35) DHODHPTGDR2DPP4DPP9DPP7
SCHEMBL8907895 0.82 HPGD (0.36) DHODHPTGDR2HPGDALDH1A1
SCHEMBL7574021 0.82 DHODH (0.36) DHODHPDE2AEPHX2CRACR2AS100A4

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 6 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
WO-1995022904-A1 PESTICIDAL METHOD RHONE POULENC AGROCHIMIE (FR) 1995-08-31 WO 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